Cas no 919522-57-9 (Benzene, 1,3-dibromo-2-chloro-4-nitro-)
919522-57-9 structure
Product Name:Benzene, 1,3-dibromo-2-chloro-4-nitro-
CAS No:919522-57-9
MF:C6H2Br2ClNO2
MW:315.34657907486
CID:762137
PubChem ID:71424962
Update Time:2025-04-19
Benzene, 1,3-dibromo-2-chloro-4-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzene, 1,3-dibromo-2-chloro-4-nitro-
- 1,3-dibromo-2-chloro-4-nitrobenzene
- 919522-57-9
- DTXSID40843751
-
- Inchi： 1S/C6H2Br2ClNO2/c7-3-1-2-4(10(11)12)5(8)6(3)9/h1-2H
- InChI Key： GCFXPZZHFUNHNE-UHFFFAOYSA-N
- SMILES： BrC1C(=C(C=CC=1[N+](=O)[O-])Br)Cl
Computed Properties
- Exact Mass: 314.81203g/mol
- Monoisotopic Mass: 312.81408g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 187
- 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
- XLogP3: 3.8
- Topological Polar Surface Area: 45.8?2
Benzene, 1,3-dibromo-2-chloro-4-nitro- Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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