Cas no 920285-21-8 (Benzenemethanamine, N-(3-bromo-2-nitrophenyl)-)
920285-21-8 structure
Product Name:Benzenemethanamine, N-(3-bromo-2-nitrophenyl)-
CAS No:920285-21-8
MF:C13H11BrN2O2
MW:307.142642259598
CID:758266
PubChem ID:57834994
Update Time:2025-04-19
Benzenemethanamine, N-(3-bromo-2-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Benzenemethanamine, N-(3-bromo-2-nitrophenyl)-
- N-benzyl-3-bromo-2-nitroaniline
- BAJJMCJCOGOAII-UHFFFAOYSA-N
- 920285-21-8
- DTXSID30728063
- Benzyl-(3-bromo-2-nitro-phenyl)-amine
- SCHEMBL3857097
-
- Inchi： 1S/C13H11BrN2O2/c14-11-7-4-8-12(13(11)16(17)18)15-9-10-5-2-1-3-6-10/h1-8,15H,9H2
- InChI Key： BAJJMCJCOGOAII-UHFFFAOYSA-N
- SMILES： BrC1=CC=CC(=C1[N+](=O)[O-])NCC1C=CC=CC=1
Computed Properties
- Exact Mass: 306.00039g/mol
- Monoisotopic Mass: 306.00039g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 3
- Complexity: 277
- 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: 4.5
- Topological Polar Surface Area: 57.8?2
Benzenemethanamine, N-(3-bromo-2-nitrophenyl)- Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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