Cas no 71491-47-9 (Benzene,2-chloro-1,4-dimethyl-3,5-dinitro-)
71491-47-9 structure
Product Name:Benzene,2-chloro-1,4-dimethyl-3,5-dinitro-
CAS No:71491-47-9
MF:C8H7ClN2O4
MW:230.605180978775
CID:565551
PubChem ID:284972
Update Time:2025-04-19
Benzene,2-chloro-1,4-dimethyl-3,5-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene,2-chloro-1,4-dimethyl-3,5-dinitro-
- 2-chloro-1,4-dimethyl-3,5-dinitrobenzene
- 2-chloro-1,4-dimethyl-3,5-dinitro-benzene
- 1-chloro-2,5-dimethyl-4,6-dinitrobenzene
- 2-Chlor-1,4-dimethyl-3,5-dinitro-benzol
- 2-Chloro-3,5-dinitro-p-xylene
- Benzene,2-chloro-1,4-dimethyl-3,5-dinitro
- Benzene,4-dimethyl-3,5-dinitro
- chloro-2 dinitro-3,5 p-xylene
- 71491-47-9
- Benzene,4-dimethyl-3,5-dinitro-
- DTXSID30301158
- NSC-141463
- NSC141463
-
- Inchi： 1S/C8H7ClN2O4/c1-4-3-6(10(12)13)5(2)8(7(4)9)11(14)15/h3H,1-2H3
- InChI Key： GPBXOXQYKHJRCX-UHFFFAOYSA-N
- SMILES： ClC1=C(C)C=C(C(C)=C1[N+](=O)[O-])[N+](=O)[O-]
Computed Properties
- Exact Mass: 230.00900
- Monoisotopic Mass: 230.009
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 0
- Complexity: 275
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.9
- Topological Polar Surface Area: 91.6?2
Experimental Properties
- Density: 1.463
- Boiling Point: 339.9°C at 760 mmHg
- Flash Point: 159.4°C
- Refractive Index: 1.599
- PSA: 91.64000
- LogP: 3.81960
Benzene,2-chloro-1,4-dimethyl-3,5-dinitro- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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