Basic information
- Standard SMILES
N#CC(C#N)Cc1ccc(Cl)cc1- InChIKey
KZVZSAZGEKLWOJ-UHFFFAOYSA-N- Molecular formula
- C10H7ClN2
- Average molar mass
- 190.63 g/mol
- Monoisotopic mass
- 190.0297759
Names & identifiers
- Preferred name
- 2-((4-Chlorophenyl)methyl)propanedinitrile
- IUPAC
- 2-[(4-chlorophenyl)methyl]propanedinitrile
- English name
- 2-[(4-chlorophenyl)methyl]propanedinitrile
- Molecular formula
- C10H7ClN2
- Molecular weight
- 190.63
Names & synonyms
2964-33-2MALONONITRILE, (p-CHLOROBENZYL)-DTXSID70183819RefChem:1060530DTXCID601063102-((4-Chlorophenyl)methyl)propanedinitrile(p-Chlorobenzyl)malononitrileBRN 20497754-Chlor-benzyl-malonitril [German]4-Chlor-benzyl-malonitril4-Chlorobenzylmalononitrile(4-chlorobenzyl)malononitrile
Show more names
2-[(4-chlorophenyl)methyl]propanedinitrilePropanedinitrile, 2-[(4-chlorophenyl)methyl]-
Propanedinitrile, ((4-chlorophenyl)methyl)-4-09-00-03360 (Beilstein Handbook Reference)SCHEMBL4657515KZVZSAZGEKLWOJ-UHFFFAOYSA-NAKOS006279865[(4-Chlorophenyl)methyl]propanedinitrile2-[(4-chlorophenyl)-methyl]-propanedinitrile
Database identifiers
- CAS
2964-33-2- PubChem CID
- 18082
- DTXSID
DTXSID70183819- Nikkaji
- J724.196H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 233
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
18 records
Linked notes
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