Basic information
- CAS
405174-42-7- Standard SMILES
O=CCn1cnc2ccccc21- InChIKey
HNVAXABRHLQAFA-UHFFFAOYSA-N- Molecular formula
- C9H8N2O
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.06366288
Names & identifiers
- Preferred name
- (1H-Benzimidazol-1-yl)acetaldehyde
- IUPAC
- 2-(benzimidazol-1-yl)acetaldehyde
- English name
- 1H-Benzimidazole-1-acetaldehyde
- Molecular formula
- C9H8N2O
- Molecular weight
- 160.17262
Names & synonyms
405174-42-7DTXSID80621570(1H-Benzimidazol-1-yl)acetaldehydeRefChem:204848DTXCID105723241h-benzimidazole-1-acetaldehyde2-(benzimidazol-1-yl)ethanalSCHEMBL2140382SCHEMBL67136662-(benzimidazol-1-yl)-ethanalSCHEMBL29958345HNVAXABRHLQAFA-UHFFFAOYSA-N
Show more names
Benzoimidazol-1-yl-acetaldehyde1H-Benzimidazole-1-acetaldehyde(9CI)
AKOS010077279(1H-1,3-Benzimidazol-1-yl)acetaldehyde2-(1H-1,3-benzodiazol-1-yl)acetaldehyde2-(1H-Benzo[d]imidazol-1-yl)acetaldehydeDB-345722
Database identifiers
- CAS
405174-42-7- PubChem CID
- 22018662
- DTXSID
DTXSID80621570
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 34.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 172
Chemistry & industry
Suppliers1 total
砌块化学科技(上海)有限公司021-20432219 13918097649 · [email protected]
Related reactions
3 records
Compound notes
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