Cas no 4445-39-0 (2-Aminobiphenyl-3-carboxylic acid)
4445-39-0 structure
Product Name:2-Aminobiphenyl-3-carboxylic acid
CAS No:4445-39-0
MF:C13H11NO2
MW:213.231943368912
CID:2827825
PubChem ID:14044025
Update Time:2025-04-21
2-Aminobiphenyl-3-carboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- SCHEMBL758071
- 4445-39-0
- 2-Amino-[1,1'-biphenyl]-3-carboxylic acid
- phenylo-aminobenzoic acid
- 2-Aminobiphenyl-3-carboxylic acid
- MB09445
- AKOS005133149
-
- Inchi: 1S/C13H11NO2/c14-12-10(9-5-2-1-3-6-9)7-4-8-11(12)13(15)16/h1-8H,14H2,(H,15,16)
- InChI Key: YMRNZNHFJGQDCB-UHFFFAOYSA-N
- SMILES: OC(C1=CC=CC(=C1N)C1C=CC=CC=1)=O
Computed Properties
- Exact Mass: 213.078978594Da
- Monoisotopic Mass: 213.078978594Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 2
- Complexity: 248
- 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: 2.9
- Topological Polar Surface Area: 63.3?2
2-Aminobiphenyl-3-carboxylic acid Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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