Cas no 915922-01-9 (2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid)
915922-01-9 structure
Product Name:2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid
CAS No:915922-01-9
MF:C13H16N2O2
MW:232.278343200684
CID:1087142
PubChem ID:3890819
Update Time:2025-04-20
2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid Chemical and Physical Properties
Names and Identifiers
-
- 2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid
- 2-(2-Propyl-1H-benzimidazol-1-yl)propanoic acid
- AKOS022185248
- 2-(2-propylbenzimidazol-1-yl)propanoic acid
- 915922-01-9
- AKOS000301859
- HMS1701O15
-
- MDL: MFCD07397339
- Inchi: 1S/C13H16N2O2/c1-3-6-12-14-10-7-4-5-8-11(10)15(12)9(2)13(16)17/h4-5,7-9H,3,6H2,1-2H3,(H,16,17)
- InChI Key: OFYZINWGFMTKOQ-UHFFFAOYSA-N
- SMILES: OC(C(C)N1C2C=CC=CC=2N=C1CCC)=O
Computed Properties
- Exact Mass: 232.121177757g/mol
- Monoisotopic Mass: 232.121177757g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 4
- Complexity: 283
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.7
- Topological Polar Surface Area: 55.1?2
2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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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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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
915922-01-9 (2-(2-Propyl-1H-benzo[d]imidazol-1-yl)propanoic acid) Related Products
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