Basic information
- CAS
159598-38-6- Standard SMILES
CSCc1nc2ccc(C)cc2[nH]1- InChIKey
LXEDCBXFRIFBGN-UHFFFAOYSA-N- Molecular formula
- C10H12N2S
- Average molar mass
- 192.28 g/mol
- Monoisotopic mass
- 192.07211956
Names & identifiers
- Preferred name
- 6-methyl-2-(methylsulfanylmethyl)-1H-benzimidazole
- IUPAC
- 6-methyl-2-(methylsulfanylmethyl)-1H-benzimidazole
- English name
- 1H-Benzimidazole,5-methyl-2-[(methylthio)methyl]-(9CI)
- Molecular formula
- C10H12N2S
- Molecular weight
- 192.28
Names & synonyms
6-methyl-2-(methylsulfanylmethyl)-1H-benzimidazole159598-38-61H-Benzimidazole,5-methyl-2-[(methylthio)methyl]-(9CI)AKOS0134848321H-Benzimidazole, 6-methyl-2-[(methylthio)methyl]-
Database identifiers
- CAS
159598-38-6- PubChem CID
- 20671239
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 174
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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