Cas no 69380-73-0 (1H-Benzimidazole-1-carboxylicacid,methylester(9CI))
69380-73-0 structure
Product Name:1H-Benzimidazole-1-carboxylicacid,methylester(9CI)
CAS No:69380-73-0
MF:C9H8N2O2
MW:176.172021865845
CID:853161
PubChem ID:13338974
Update Time:2025-04-19
1H-Benzimidazole-1-carboxylicacid,methylester(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-1-carboxylicacid,methylester(9CI)
- methyl benzimidazole-1-carboxylate
- SCHEMBL9791225
- Methyl 1H-benzimidazole-1-carboxylate
- 1-methoxycarbonylbenzimidazole
- OJHVSVKKRBFAEY-UHFFFAOYSA-N
- DTXSID80537384
- 69380-73-0
-
- Inchi： 1S/C9H8N2O2/c1-13-9(12)11-6-10-7-4-2-3-5-8(7)11/h2-6H,1H3
- InChI Key： OJHVSVKKRBFAEY-UHFFFAOYSA-N
- SMILES： O(C)C(N1C=NC2C=CC=CC1=2)=O
Computed Properties
- Exact Mass: 176.058577502g/mol
- Monoisotopic Mass: 176.058577502g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 208
- 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: 1.7
- Topological Polar Surface Area: 44.1?2
1H-Benzimidazole-1-carboxylicacid,methylester(9CI) Related Literature
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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