Basic information
- CAS
61555-46-2- Standard SMILES
CN(C(=O)CCl)C(C#N)c1ccccc1- InChIKey
DWAGEVKHFVHQFS-UHFFFAOYSA-N- Molecular formula
- C11H11ClN2O
- Average molar mass
- 222.67 g/mol
- Monoisotopic mass
- 222.0559907
Names & identifiers
- Preferred name
- 2-Chloro-N-[cyano(phenyl)methyl]-N-methylacetamide
- IUPAC
- 2-chloro-N-[cyano(phenyl)methyl]-N-methylacetamide
Names & synonyms
61555-46-22-Chloro-N-[cyano(phenyl)methyl]-N-methylacetamideAcetamide, 2-chloro-N-(cyanophenylmethyl)-N-methyl-SCHEMBL11259840DTXSID60513585
Database identifiers
- CAS
61555-46-2- PubChem CID
- 12945481
- DTXSID
DTXSID60513585
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 265
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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