Basic information
- CAS
6307-14-8- Standard SMILES
Cc1[nH]cnc1S(=O)(=O)O- InChIKey
KGDKWOYOXAFWLV-UHFFFAOYSA-N- Molecular formula
- C4H6N2O3S
- Average molar mass
- 162.17 g/mol
- Monoisotopic mass
- 162.00991323
Names & identifiers
- Preferred name
- 5-Methyl-1h-imidazole-4-sulfonic acid
- IUPAC
- 5-methyl-1H-imidazole-4-sulfonic acid
- English name
- 5-methylimidazole-4-sulfonic acid
- Molecular formula
- C4H6N2O3S
- Molecular weight
- 162.17
Names & synonyms
6307-14-85-methyl-1h-imidazole-4-sulfonic acid5-METHYLIMIDAZOLE-4-SULFONIC ACID4-Methyl-1H-imidazole-5-sulfonic acidNSC41089SCHEMBL10714709SCHEMBL18116876DTXSID20285216NSC 41089NSC-410891H-Imidazole-5-sulfonic acid, 4-methyl-
Database identifiers
- CAS
6307-14-8- PubChem CID
- 237484
- DTXSID
DTXSID20285216- Nikkaji
- J1.555.518A
Properties
Computed structural properties
- XLogP
- -0.5
- Topological polar surface area
- 91.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 207
Chemistry & industry
Suppliers7 total
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
PT CHEM GROUP LIMITED+86-85511178; +86-85511178 · [email protected]
Alfa Chemistry+1-5166625404 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
重庆卡兰医药有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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