Basic information
- CAS
38677-64-4- Standard SMILES
Cn1c(SCC(O)CCl)nc2ccccc21- InChIKey
UXKDNDHDIFMUBF-UHFFFAOYSA-N- Molecular formula
- C11H13ClN2OS
- Average molar mass
- 256.75 g/mol
- Monoisotopic mass
- 256.0437119
Names & identifiers
- Preferred name
- 2-Propanol, 1-chloro-3-((1-methyl-1H-benzimidazol-2-yl)thio)-
- IUPAC
- 1-chloro-3-(1-methylbenzimidazol-2-yl)sulfanylpropan-2-ol
Names & synonyms
38677-64-42-Propanol, 1-chloro-3-((1-methyl-1H-benzimidazol-2-yl)thio)-DTXSID309595121-Chloro-3-[(1-methyl-1H-benzimidazol-2-yl)sulfanyl]propan-2-ol1-Chloro-3-[(1-methyl-1H-1,3-benzimidazol-2-yl)sulfanyl]propan-2-ol
Database identifiers
- CAS
38677-64-4- PubChem CID
- 148261
- DTXSID
DTXSID30959512
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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