p,p'-DDCN
Basic information
- CAS
20968-04-1- Standard SMILES
N#CC(c1ccc(Cl)cc1)c1ccc(Cl)cc1- InChIKey
FOWHYJUXPOOLJN-UHFFFAOYSA-N- Molecular formula
- C14H9Cl2N
- Average molar mass
- 262.1 g/mol
- Monoisotopic mass
- 261.0112047
Names & identifiers
- Preferred name
- p,p'-DDCN
- IUPAC
- 2,2-bis(4-chlorophenyl)acetonitrile
- English name
- bis(p-chlorophenyl)acetonitrile
- Molecular formula
- C14H9Cl2N
- Molecular weight
- 262.13
Names & synonyms
20968-04-1BIS(P-CHLOROPHENYL)ACETONITRILEp,p'-DdcnDTXSID80175144RefChem:169246DTXCID80976352,2-bis(4-chlorophenyl)acetonitrileBenzeneacetonitrile, 4-chloro-alpha-(4-chlorophenyl)-MFCD19303617bis(4-chlorophenyl)acetonitrileSCHEMBL7825067FOWHYJUXPOOLJN-UHFFFAOYSA-N
Show more names
Benzeneacetonitrile, 4-chloro-α-(4-chlorophenyl)-
2,2-bis(4-chlorophenyl)-acetonitrileAKOS022507371Bis(p-chlorophenyl)acetonitrile, 95%BS-15940SY421261CS-0163191A10814F545264
Database identifiers
- CAS
20968-04-1- PubChem CID
- 8806
- DTXSID
DTXSID80175144- Nikkaji
- J630.129K
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- storage temp.
- Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Related reactions
2 records
Compound notes
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