Completing data — usually done within a minute
Basic information
- CAS
3138-23-6- Standard SMILES
N#CC(C#N)=Cc1ccc(Cl)c(Cl)c1- InChIKey
LHEPUPUAFKDYOB-UHFFFAOYSA-N- Molecular formula
- C10H4Cl2N2
- Average molar mass
- 223.05 g/mol
- Monoisotopic mass
- 221.9751535
Names & identifiers
- Preferred name
- (3,4-Dichlorobenzylidene)malononitrile
- IUPAC
- 2-[(3,4-dichlorophenyl)methylidene]propanedinitrile
Names & synonyms
(3,4-dichlorobenzylidene)malononitrile3138-23-6DTXSID20277035RefChem:207356DTXCID90228195Propanedinitrile,2-[(3,4-dichlorophenyl)methylene]-2-(3,4-dichlorobenzylidene)malononitrile2-[(3,4-dichlorophenyl)methylidene]propanedinitrileNSC4943,4-DICHLOROBENZYLIDENEMALONONITRILESCHEMBL4656260NSC-494
Show more names
LHEPUPUAFKDYOB-UHFFFAOYSA-NAKOS001114321UPCMLD0ENAT5418587:001DS-012304ST50561087[(3,4-Dichlorophenyl)methylidene]propanedinitrileZ44300032[(3,4-dichlorophenyl)methylene]methane-1,1-dicarbonitrile
Database identifiers
- CAS
3138-23-6- PubChem CID
- 219328
- DTXSID
DTXSID20277035- Nikkaji
- J2.035.148I
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 313
Related reactions
3 records
Compound notes
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