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Volumn 35, Issue 2, 2010, Pages 175-181

Simple relationship for predicting impact sensitivity of nitroaromatics, nitramines, and nitroaliphatics

Author keywords

Impact sensitivity; Nitramine; Nitroaliphatic; Nitroaromatic; Safety

Indexed keywords

CHEMICAL FAMILY; ELEMENTAL COMPOSITIONS; EMPIRICAL CORRELATIONS; ENERGETIC COMPOUNDS; IMPACT SENSITIVITIES; NITRAMINES; NITRO-AROMATICS; ROOT MEAN SQUARE; SIMPLE MODEL; STRUCTURAL PARAMETER; TEST SETS;

EID: 77950810877     PISSN: 07213115     EISSN: 15214087     Source Type: Journal    
DOI: 10.1002/prep.200800078     Document Type: Article
Times cited : (72)

References (44)
  • 1
    • 0011113160 scopus 로고
    • Sensitivity relationships in energetic materials
    • S. N. Bulusu (Ed.), Kluwer Academic Publishers, Dordrecht, The Netherlands
    • C. B. Storm, J. R. Stine, J. F. Kramer, Sensitivity Relationships in Energetic Materials, in: S. N. Bulusu (Ed.), Chemistry and Physics of Energetic Materials, Kluwer Academic Publishers, Dordrecht, The Netherlands, 1990, pp. 605.
    • (1990) Chemistry and Physics of Energetic Materials , pp. 605
    • Storm, C.B.1    Stine, J.R.2    Kramer, J.F.3
  • 4
    • 0002173890 scopus 로고
    • Relation entre la Structure Electronique et la Sensibilité au Choc des Explosifs Secondaires Nitré s. III. Influence de l-environnement cristallin
    • A. Delpuech, J. Cherville, Relation entre la Structure Electronique et la Sensibilité au Choc des Explosifs Secondaires Nitré s. III. Influence de l-environnement cristallin, Propellants, Explos., Pyrotech. 1979, 4, 61.
    • (1979) Propellants, Explos., Pyrotech. , vol.4 , pp. 61
    • Delpuech, A.1    Cherville, J.2
  • 5
    • 0000153882 scopus 로고
    • Computational analysis of some properties associated with the nitro groups in polynitroaromatic molecules
    • F. J. Owens, K. Jayasuriya, L. Abrahmsen, P. Politzer, Computational Analysis of Some Properties Associated with the Nitro Groups in Polynitroaromatic Molecules, Chem. Phys. Lett. 1985, 116, 434.
    • (1985) Chem. Phys. Lett. , vol.116 , pp. 434
    • Owens, F.J.1    Jayasuriya, K.2    Abrahmsen, L.3    Politzer, P.4
  • 10
    • 23644455519 scopus 로고    scopus 로고
    • Simple empirical method for prediction of impact sensitivity of selected class of explosives
    • M. H. Keshavarz, H. R. Pouretedal, Simple Empirical Method for Prediction of Impact Sensitivity of Selected Class of Explosives, J. Hazard. Mater. A 2005, 124, 27.
    • (2005) J. Hazard. Mater. A , vol.124 , pp. 27
    • Keshavarz, M.H.1    Pouretedal, H.R.2
  • 11
    • 0037035164 scopus 로고    scopus 로고
    • A Quantum mechanical investigation of the relation between impact sensitivity and the charge distribution in energetic molecules
    • B. M. Rice, J. J. Hare, A Quantum Mechanical Investigation of the Relation between Impact Sensitivity and the Charge Distribution in Energetic Molecules, J. Phys. Chem. A 2002, 106, 1770.
    • (2002) J. Phys. Chem. A , vol.106 , pp. 1770
    • Rice, B.M.1    Hare, J.J.2
  • 12
    • 33745781474 scopus 로고    scopus 로고
    • Investigation of the various structure parameters for predicting impact sensitivity of energetic molecules via artificial neural network
    • M. H. Keshavarz, M. Jaafari, Investigation of the Various Structure Parameters for Predicting Impact Sensitivity of Energetic Molecules via Artificial Neural Network, Propellants, Explos., Pyrotech. 2006, 31, 216.
    • (2006) Propellants, Explos., Pyrotech. , vol.31 , pp. 216
    • Keshavarz, M.H.1    Jaafari, M.2
  • 14
    • 0021372291 scopus 로고
    • Effects of amino and nitro substituents upon the electrostatic potential of an aromatic ring
    • P. Politzer, L. Abrahmsen, P. Sjoberg, Effects of Amino and Nitro Substituents upon the Electrostatic Potential of an Aromatic Ring, J. Am. Chem. Soc. 1984, 106, 855.
    • (1984) J. Am. Chem. Soc. , vol.106 , pp. 855
    • Politzer, P.1    Abrahmsen, L.2    Sjoberg, P.3
  • 16
    • 0000592724 scopus 로고    scopus 로고
    • 2 Bonds: Applications to Impact Sensitivities
    • 2 Bonds: Applications to Impact Sensitivities, J. Mol. Struct. 1996, 376, 419.
    • (1996) J. Mol. Struct. , vol.376 , pp. 419
    • Politzer, P.1    Murray, J.S.2
  • 18
    • 0011113161 scopus 로고    scopus 로고
    • Computational studies of energetic organic molecules
    • Markinas P. L., Ed., Nova Science Publishers, New York
    • P. Politzer, J. S. Murray, Computational Studies of Energetic Organic Molecules, in: Organic Energetic Compounds, Markinas P. L., Ed., Nova Science Publishers, New York 1996.
    • (1996) Organic Energetic Compounds
    • Politzer, P.1    Murray, J.S.2
  • 19
    • 0040495192 scopus 로고
    • The theoretical study on sensitivity and stability of polynitro arenes I. Nitro derivatives of aminobenzenes
    • H. M. Xiao, Z. Y. Wang, J. M. Yao, The Theoretical Study on Sensitivity and Stability of Polynitro Arenes I. Nitro Derivatives of Aminobenzenes, Acta Chim. Sin. 1985, 43, 14.
    • (1985) Acta Chim. Sin. , vol.43 , pp. 14
    • Xiao, H.M.1    Wang, Z.Y.2    Yao, J.M.3
  • 20
    • 30244537846 scopus 로고    scopus 로고
    • Theoretical study on pyrolysis and sensitivity of energetic compounds. (2) Nitro derivatives of benzene
    • J. Fan, H. M. Xiao, Theoretical Study on Pyrolysis and Sensitivity of Energetic Compounds. (2) Nitro Derivatives of Benzene, J. Mol. Struct. (THEOCHEM) 1996, 365, 225.
    • (1996) J. Mol. Struct. THEOCHEM , vol.365 , pp. 225
    • Fan, J.1    Xiao, H.M.2
  • 21
    • 0032345878 scopus 로고    scopus 로고
    • Theoretical study on pyrolysis and sensitivity of energetic compounds: (3) Nitro Derivatives of Aminobenzenes
    • H. M. Xiao, J. F. Fan, Z. M. Gu, H. S. Dong, Theoretical Study on Pyrolysis and Sensitivity of Energetic compounds: (3) Nitro Derivatives of Aminobenzenes, Chem. Phys. 1998, 226, 15.
    • (1998) Chem. Phys. , vol.226 , pp. 15
    • Xiao, H.M.1    Fan, J.F.2    Gu, Z.M.3    Dong, H.S.4
  • 22
    • 0000596999 scopus 로고    scopus 로고
    • Theoretical study on pyrolysis and sensitivity of energetic compounds. Part 4. Nitro Derivatives of Phenols
    • J. Fan, Z. Gu, H. M. Xiao, H. Dong, Theoretical Study on Pyrolysis and Sensitivity of Energetic Compounds. Part 4. Nitro Derivatives of Phenols, J. Phys. Org. Chem. 1998, 11, 177.
    • (1998) J. Phys. Org. Chem. , vol.11 , pp. 177
    • Fan, J.1    Gu, Z.2    Xiao, H.M.3    Dong, H.4
  • 23
    • 0033262121 scopus 로고    scopus 로고
    • Theoretical investigation on the impact sensitivity of tetrazole derivatives and their metal salts
    • Z. X. Chen, M. H. Xiao, S. L. Yang, Theoretical Investigation on the Impact Sensitivity of Tetrazole Derivatives and Their Metal Salts, Chem. Phys. 1999, 250, 243.
    • (1999) Chem. Phys. , vol.250 , pp. 243
    • Chen, Z.X.1    Xiao, M.H.2    Yang, S.L.3
  • 24
    • 0542415700 scopus 로고
    • Relationships between Impact Sensitivities and Molecular Surface Electrostatic Potentials of Nitroaromatic and Nitroheterocyclic Molecules
    • J. S. Murray, P. Lane, and P. Politzer, Relationships between Impact Sensitivities and Molecular Surface Electrostatic Potentials of Nitroaromatic and Nitroheterocyclic Molecules, Mol. Phys. 1995, 85, 1.
    • (1995) Mol. Phys. , vol.85 , pp. 1
    • Murray, J.S.1    Lane, P.2    Politzer, P.3
  • 25
    • 0000808656 scopus 로고    scopus 로고
    • Effects of strongly electronattracting components on molecular surface electrostatic potentials: Application to predicting impact sensitivities of energetic molecules
    • J. S. Murray, P. Lane, P. Politzer, Effects of Strongly Electronattracting Components on Molecular Surface Electrostatic Potentials: Application to Predicting Impact Sensitivities of Energetic Molecules, Mol. Phys. 1998, 93, 187.
    • (1998) Mol. Phys. , vol.93 , pp. 187
    • Murray, J.S.1    Lane, P.2    Politzer, P.3
  • 26
    • 8344229967 scopus 로고    scopus 로고
    • Correlation between Sensitivity and Approximated Heats of Detonation of Several Nitroamines Using Quantum Mechanical Methods
    • J. Edwards, C. Eybl, B. Johnson, Correlation between Sensitivity and Approximated Heats of Detonation of Several Nitroamines Using Quantum Mechanical Methods, Int. J. Quantum Chem. 2004, 100, 713.
    • (2004) Int. J. Quantum Chem. , vol.100 , pp. 713
    • Edwards, J.1    Eybl, C.2    Johnson, B.3
  • 27
    • 33745736729 scopus 로고    scopus 로고
    • Theoretical Investigation of the Relationship between Impact Sensitivity and the Charges of the Nitro Group in Nitro Compounds
    • C. Zhang, Y. Shu, Y. Huang, X. Wang, Theoretical Investigation of the Relationship between Impact Sensitivity and the Charges of the Nitro Group in Nitro Compounds, J. Energ. Mater. 2005, 23, 107.
    • (2005) J. Energ. Mater. , vol.23 , pp. 107
    • Zhang, C.1    Shu, Y.2    Huang, Y.3    Wang, X.4
  • 28
    • 19944421798 scopus 로고    scopus 로고
    • Investigation of correlation between impact sensitivities and nitro group charges in nitro compounds
    • C. Zhang, Y. Shu, Y. Huang, X. Zhao, H. Dong, Investigation of Correlation between Impact Sensitivities and Nitro Group Charges in Nitro Compounds, J. Phys. Chem. B 2005, 109, 8978.
    • (2005) J. Phys. Chem. B , vol.109 , pp. 8978
    • Zhang, C.1    Shu, Y.2    Huang, Y.3    Zhao, X.4    Dong, H.5
  • 29
    • 23844527402 scopus 로고    scopus 로고
    • A New method to evaluate the stability of the covalent compound: By the charges on the common atom or group
    • C. Zhang, Y. Shu, X. Wang, X. Zhao, A New Method to Evaluate the Stability of the Covalent Compound: By the Charges on the Common Atom or Group, J. Phys. Chem. A 2005, 109, 6592.
    • (2005) J. Phys. Chem. A , vol.109 , pp. 6592
    • Zhang, C.1    Shu, Y.2    Wang, X.3    Zhao, X.4
  • 31
    • 33745778412 scopus 로고
    • Sensitivity relationships
    • Princeton, New Jersey, September 26 - 28
    • M. J. Kamlet, Sensitivity Relationships, 3th Symposium (International) on Detonation, Princeton, New Jersey, September, 26 - 28, 1968, p. 671.
    • (1968) 3th Symposium (International) on Detonation , pp. 671
    • Kamlet, M.J.1
  • 32
    • 0003460760 scopus 로고
    • The relationship of impact sensitivity with structure of organic high explosives: I. Polynitroaliphatic explosives
    • Coronado, CA, August, 24 - 27
    • M. J. Kamlet, The Relationship of Impact Sensitivity with Structure of Organic High Explosives: I. Polynitroaliphatic Explosives, 6th Symposium (International) on Detonation, Coronado, CA, August, 24 - 27, 1976, p. 312.
    • (1976) 6th Symposium (International) on Detonation , pp. 312
    • Kamlet, M.J.1
  • 33
    • 0018454474 scopus 로고
    • The relationship of impact sensitivity with structure of organic high explosives. Part II. polynitroaromatic explosives
    • M. J. Kamlet, H. G. Adolph, The Relationship of Impact Sensitivity with Structure of Organic High Explosives. Part II. Polynitroaromatic Explosives, Propellants, Explos., Pyrotech. 1979, 4, 30.
    • (1979) Propellants, Explos., Pyrotech. , vol.4 , pp. 30
    • Kamlet, M.J.1    Adolph, H.G.2
  • 34
    • 0023330666 scopus 로고
    • A Relationship between impact sensitivity and molecular electronegativity
    • J. Mullay, A Relationship between Impact Sensitivity and Molecular Electronegativity, Propellants, Explos., Pyrotech. 1987, 12, 60.
    • (1987) Propellants, Explos., Pyrotech. , vol.12 , pp. 60
    • Mullay, J.1
  • 35
    • 0023395260 scopus 로고
    • Relationships between impact sensitivity and molecular electronic structure
    • J. Mullay, Relationships between Impact Sensitivity and Molecular Electronic Structure, Propellants, Explos., Pyrotech. 1987, 12, 121.
    • (1987) Propellants, Explos., Pyrotech. , vol.12 , pp. 121
    • Mullay, J.1
  • 36
    • 0028515355 scopus 로고
    • Energy transfer rates in primary, secondary, and insensitive explosives
    • L. E. Fried, A. J. Ruggiero, Energy Transfer Rates in Primary, Secondary, and Insensitive Explosives, J. Phys. Chem. 1994, 98, 9786.
    • (1994) J. Phys. Chem. , vol.98 , pp. 9786
    • Fried, L.E.1    Ruggiero, A.J.2
  • 37
    • 0000092677 scopus 로고    scopus 로고
    • Spectroscopic determination of impact sensitivities of explosives spectroscopic determination of impact sensitivities of explosives
    • K. L. McNesby, C. S. Coffey, Spectroscopic Determination of Impact Sensitivities of Explosives Spectroscopic Determination of Impact Sensitivities of Explosives, J. Phys. Chem. B 1997, 101, 3097.
    • (1997) J. Phys. Chem. B , vol.101 , pp. 3097
    • McNesby, K.L.1    Coffey, C.S.2
  • 38
    • 0018678428 scopus 로고
    • Relation entre la Structure Electronique et la Sensibilité au Choc des Explosifs Secondaires Nitré s. Critère Moléculaire de Sensibilité II. Cas des esters nitriques
    • A. Delpuech, J. Cherville, Relation entre la Structure Electronique et la Sensibilité au Choc des Explosifs Secondaires Nitré s. Critère Moléculaire de Sensibilité II. Cas des esters nitriques, Propellants, Explos., Pyrotech. 1979, 4, 121.
    • (1979) Propellants, Explos., Pyrotech. , vol.4 , pp. 121
    • Delpuech, A.1    Cherville, J.2
  • 39
    • 0023593467 scopus 로고
    • Energetics of propellants, fuels and explosives; A chemical valence approach
    • S. R. Jain, Energetics of Propellants, Fuels and Explosives; A Chemical Valence Approach, Propellants, Explos., Pyrotech. 1987, 12, 188.
    • (1987) Propellants, Explos., Pyrotech. , vol.12 , pp. 188
    • Jain, S.R.1
  • 40
    • 0020223946 scopus 로고
    • Some comments regarding the sensitivities thermal stabilities and explosive performance characteristics of fluorodinitromethyl compounds
    • Annapolis Maryland June 16 - 19
    • M. J. Kamlet, H. G. Adolph, Some Comments Regarding the Sensitivities, Thermal Stabilities, and Explosive Performance Characteristics of Fluorodinitromethyl Compounds, 7th Symposium (International) on Detonation, Annapolis, Maryland, June, 16 - 19, 1981, p. 84.
    • (1981) 7th Symposium (International) on Detonation , pp. 84
    • Kamlet, M.J.1    Adolph, H.G.2
  • 41
    • 0018057016 scopus 로고
    • Relation entre la Structure Electronique et la Sensibilité au Choc des Explosifs Secondaires Nitrés-Critère Moléculaire de Sensibilité.I. Cas des Nitroaromatiques et des Nitramines
    • A. Delpuech, J. Cherville, Relation entre la Structure Electronique et la Sensibilité au Choc des Explosifs Secondaires Nitrés- Critère Moléculaire de Sensibilité. I. Cas des Nitroaromatiques et des Nitramines, Propellants, Explos., Pyrotech. 1978, 3, 169.
    • (1978) Propellants, Explos., Pyrotech. , vol.3 , pp. 169
    • Delpuech, A.1    Cherville, J.2
  • 42
    • 34548279522 scopus 로고    scopus 로고
    • Prediction of impact sensitivity of nitroaliphatic, nitroaliphatic containing other functional groups and nitrate explosives
    • M. H. Keshavarz, Prediction of Impact Sensitivity of Nitroaliphatic, Nitroaliphatic Containing Other Functional Groups and Nitrate Explosives, J. Hazard. Mater. 2007, 148, 648.
    • (2007) J. Hazard. Mater. , vol.148 , pp. 648
    • Keshavarz, M.H.1
  • 43
    • 33847414188 scopus 로고    scopus 로고
    • Novel correlation for predicting impact sensitivity of nitroheterocyclic energetic molecules
    • M. H. Keshavarz, H. R. Pouretedal, A. Semnani, Novel Correlation for Predicting Impact Sensitivity of Nitroheterocyclic Energetic Molecules, J. Hazard. Mater. 2007, 141, 803.
    • (2007) J. Hazard. Mater. , vol.141 , pp. 803
    • Keshavarz, M.H.1    Pouretedal, H.R.2    Semnani, A.3


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