Cas no 1096945-26-4 (6-Chloro-3-nitro-N-o-tolylpyridin-2-amine)
1096945-26-4 structure
Product Name:6-Chloro-3-nitro-N-o-tolylpyridin-2-amine
CAS No:1096945-26-4
MF:C12H10ClN3O2
MW:263.679701328278
CID:2108149
Update Time:2023-08-03
6-Chloro-3-nitro-N-o-tolylpyridin-2-amine Chemical and Physical Properties
Names and Identifiers
-
- 6-chloro-3-nitro-N-o-tolylpyridin-2-amine
- XSFTVASHDOPYNR-UHFFFAOYSA-N
- 6-Chloro-3-nitro-N-o-tolylpyridin-2-amine
-
- Inchi： 1S/C12H10ClN3O2/c1-8-4-2-3-5-9(8)14-12-10(16(17)18)6-7-11(13)15-12/h2-7H,1H3,(H,14,15)
- InChI Key： XSFTVASHDOPYNR-UHFFFAOYSA-N
- SMILES： ClC1=CC=C(C(=N1)NC1C=CC=CC=1C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 263.046
- Monoisotopic Mass: 263.046
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 298
- 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
- Topological Polar Surface Area: 70.7
6-Chloro-3-nitro-N-o-tolylpyridin-2-amine 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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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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