Cas no 41139-95-1 ( )
structure
Product Name:
CAS No:41139-95-1
MF:C13H12N2O2
MW:228.246582984924
CID:926626
PubChem ID:298499
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 2-(4-aminoanilino)benzoic acid
- 2-[(4-Aminophenyl)amino]benzoic acid
- 4'-Amino-diphenylamin-carbonsaeure-(2)
- 4-amino-diphenylamine-2'-carboxylic acid
- AC1L6T7V
- N-(4-amino-phenyl)-anthranilic acid
- N-(4-Amino-phenyl)-anthranilsaeure
- NSC170667
- SureCN2128794
- 41139-95-1
- NSC-170667
- DTXSID00305401
- SCHEMBL2128794
-
-
- Inchi： 1S/C13H12N2O2/c14-9-5-7-10(8-6-9)15-12-4-2-1-3-11(12)13(16)17/h1-8,15H,14H2,(H,16,17)
- InChI Key： UQBGXJCUJOULGZ-UHFFFAOYSA-N
- SMILES： OC(C1C=CC=CC=1NC1C=CC(=CC=1)N)=O
Computed Properties
- Exact Mass: 228.08996
- Monoisotopic Mass: 228.089877630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 262
- 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: 3.7
- Topological Polar Surface Area: 75.4?2
Experimental Properties
- PSA: 75.35
Related Literature
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
Jianyao Huang,Dong Gao,Zhihui Chen,Weifeng Zhang Polym. Chem., 2021,12, 2471-2480
-
Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
-
Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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