Cas no 145120-74-7 (1H-Benzimidazole-2-sulfenicacid, 1-methyl-)
145120-74-7 structure
Product Name:1H-Benzimidazole-2-sulfenicacid, 1-methyl-
CAS No:145120-74-7
MF:C8H8N2OS
MW:180.226920127869
CID:101866
PubChem ID:45078092
Update Time:2025-04-18
1H-Benzimidazole-2-sulfenicacid, 1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-Benzimidazole-2-sulfenicacid, 1-methyl-
- 2-hydroxysulfanyl-1-methylbenzimidazole
- DTXSID70663444
- 1-Methyl-1H-benzimidazole-2-SO-thioperoxol
- (1-Methyl-1H-benzo[d]imidazol-2-yl)sulfanol
- 145120-74-7
-
- Inchi： 1S/C8H8N2OS/c1-10-7-5-3-2-4-6(7)9-8(10)12-11/h2-5,11H,1H3
- InChI Key： AFPLLMWCJRDRNM-UHFFFAOYSA-N
- SMILES： S(C1=NC2C=CC=CC=2N1C)O
Computed Properties
- Exact Mass: 180.036
- Monoisotopic Mass: 180.036
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 167
- 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: 1.2
- Topological Polar Surface Area: 63.4A^2
1H-Benzimidazole-2-sulfenicacid, 1-methyl- Related Literature
-
Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
-
Xin Li,Liangliang Zhu,Sai Duan,Yanli Zhao,Hans ?gren Phys. Chem. Chem. Phys., 2014,16, 23854-23860
-
Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
-
Sandip Gangadhar Balwe,Yeon Tae Jeong Org. Biomol. Chem., 2018,16, 1287-1296
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