Basic information
- Standard SMILES
CC(=NOCC#N)c1ccc(Cl)cc1- InChIKey
YZNBISHGWNOKRZ-UHFFFAOYSA-N- Molecular formula
- C10H9ClN2O
- Average molar mass
- 208.64 g/mol
- Monoisotopic mass
- 208.0403406
Names & identifiers
- Preferred name
- (alpha-Methyl-4-chlorobenzylidene amino)oxy acetonitrile
- IUPAC
- 2-[1-(4-chlorophenyl)ethylideneamino]oxyacetonitrile
Names & synonyms
SCHEMBL11407417YZNBISHGWNOKRZ-UHFFFAOYSA-N(alpha-methyl-4-chlorobenzylidene amino)oxy acetonitrile
Database identifiers
- PubChem CID
- 54535538
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 45.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 248
Related reactions
1 records
Compound notes
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