Cas no 88797-66-4 (1H-Benzimidazole-1-propanoic acid, 2-phenyl-)
88797-66-4 structure
Product Name:1H-Benzimidazole-1-propanoic acid, 2-phenyl-
CAS No:88797-66-4
MF:C16H14N2O2
MW:266.294563770294
CID:621352
PubChem ID:13207857
Update Time:2025-04-19
1H-Benzimidazole-1-propanoic acid, 2-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-1-propanoic acid, 2-phenyl-
- 3-(2-phenylbenzimidazol-1-yl)propanoic acid
- SCHEMBL9694037
- DTXSID50527873
- AKOS009114323
- 88797-66-4
- 3-(2-Phenyl-1H-benzimidazol-1-yl)propanoic acid
-
- Inchi： 1S/C16H14N2O2/c19-15(20)10-11-18-14-9-5-4-8-13(14)17-16(18)12-6-2-1-3-7-12/h1-9H,10-11H2,(H,19,20)
- InChI Key： MBBFDTZKXGHZNC-UHFFFAOYSA-N
- SMILES： OC(CCN1C(C2C=CC=CC=2)=NC2C=CC=CC1=2)=O
Computed Properties
- Exact Mass: 266.105527694g/mol
- Monoisotopic Mass: 266.105527694g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 341
- 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: 2.5
- Topological Polar Surface Area: 55.1?2
1H-Benzimidazole-1-propanoic acid, 2-phenyl- Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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