Cas no 33809-91-5 (1H-Benzimidazole-2-methanol,2-acetate)
33809-91-5 structure
Product Name:1H-Benzimidazole-2-methanol,2-acetate
CAS No:33809-91-5
MF:C10H10N2O2
MW:190.198602199554
CID:294464
PubChem ID:14262259
Update Time:2025-04-19
1H-Benzimidazole-2-methanol,2-acetate Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-2-methanol,2-acetate
- 2-acetoxymethylbenzimidazole
- 1H-Benzimidazole-2-methanol,acetate (ester) (9CI)
- 2-Benzimidazolemethanol, acetate (7CI)
- 2-Benzimidazolemethanol, acetate (ester) (8CI)
- 33809-91-5
- SCHEMBL9673902
- 2-(acetoxymethyl)benzimidazole
- KTLXBVGBWNYAQW-UHFFFAOYSA-N
- (1H-Benzo[d]imidazol-2-yl)methyl acetate
-
- Inchi： 1S/C10H10N2O2/c1-7(13)14-6-10-11-8-4-2-3-5-9(8)12-10/h2-5H,6H2,1H3,(H,11,12)
- InChI Key： KTLXBVGBWNYAQW-UHFFFAOYSA-N
- SMILES： O(C(C)=O)CC1=NC2C=CC=CC=2N1
Computed Properties
- Exact Mass: 190.074227566g/mol
- Monoisotopic Mass: 190.074227566g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 14
- Rotatable Bond Count: 3
- Complexity: 220
- 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: 1.5
- Topological Polar Surface Area: 55?2
1H-Benzimidazole-2-methanol,2-acetate Related Literature
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Liao Xiaoqing,Li Ruiyi,Li Zaijun,Sun Xiulan,Wang Zhouping,Liu Junkang New J. Chem., 2015,39, 5240-5248
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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