Cas no 87317-06-4 (Benzenesulfonamide, N-(2-chloro-4-nitrophenyl)-3-nitro-)
87317-06-4 structure
Product Name:Benzenesulfonamide, N-(2-chloro-4-nitrophenyl)-3-nitro-
CAS No:87317-06-4
MF:C12H8ClN3O6S
MW:357.726420402527
CID:657409
PubChem ID:4380252
Update Time:2025-04-19
Benzenesulfonamide, N-(2-chloro-4-nitrophenyl)-3-nitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide, N-(2-chloro-4-nitrophenyl)-3-nitro-
- N-(2-chloro-4-nitrophenyl)-3-nitrobenzenesulfonamide
- DTXSID40402640
- SCHEMBL10529379
- CHEMBL2272659
- 87317-06-4
-
- Inchi： 1S/C12H8ClN3O6S/c13-11-7-9(16(19)20)4-5-12(11)14-23(21,22)10-3-1-2-8(6-10)15(17)18/h1-7,14H
- InChI Key： WJPLBDWKVUTVQM-UHFFFAOYSA-N
- SMILES： ClC1C=C(C=CC=1NS(C1C=CC=C(C=1)[N+](=O)[O-])(=O)=O)[N+](=O)[O-]
Computed Properties
- Exact Mass: 356.9822339g/mol
- Monoisotopic Mass: 356.9822339g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 23
- Rotatable Bond Count: 3
- Complexity: 555
- 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: 2.3
- Topological Polar Surface Area: 146?2
Benzenesulfonamide, N-(2-chloro-4-nitrophenyl)-3-nitro- Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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