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(p-Chlorobenzyl)((p-chlorophenyl)azo)malononitrile

HCID 19445
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Basic information

CAS
3701-20-0
Standard SMILES
N#CC(C#N)C(N=Nc1ccc(Cl)cc1)c1ccc(Cl)cc1
InChIKey
AZWDXLKWRGSEDS-UHFFFAOYSA-N
Molecular formula
C16H10Cl2N4
Average molar mass
329.2 g/mol
Monoisotopic mass
328.0282517

Names & identifiers

Preferred name
(p-Chlorobenzyl)((p-chlorophenyl)azo)malononitrile
IUPAC
2-[(4-chlorophenyl)-[(4-chlorophenyl)diazenyl]methyl]propanedinitrile

Names & synonyms

(p-Chlorobenzyl)((p-chlorophenyl)azo)malononitrile3701-20-0F 23074-Chlor-phenyl-azo-(4'-chlor-benzyl)-malonitril [German]MALONONITRILE, (p-CHLOROBENZYL)((p-CHLOROPHENYL)AZO)-4-Chlor-phenyl-azo-(4'-chlor-benzyl)-malonitril

Database identifiers

CAS
3701-20-0
PubChem CID
19445

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
72.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Formal charge
0
Complexity
457

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