2,6-Dichlorocinnamylidenemalononitrile

Base Information

• Chemical Name: 2,6-Dichlorocinnamylidenemalononitrile
• CAS No.: 101756-27-8
• Molecular Formula: C12H6 Cl2 N2
• NSC Number: 659248
• Nikkaji Number: J147.625D
• ChEMBL ID: CHEMBL1981062
• Mol file: 101756-27-8.mol

Synonyms:2,6-Dichlorocinnamylidenemalononitrile;NSC659248;BRN 2581452;(3-2,6-Dichlorocinnamylidine)malononitrile;MALONONITRILE, (2,6-DICHLOROCINNAMYLIDENE)-;C12H6Cl2N2;101756-27-8;CHEMBL1981062;C12-H6-Cl2-N2;2-[(E)-3-(2,6-dichlorophenyl)prop-2-enylidene]propanedinitrile;NSC-659248;LS-88911;3-(2,6-Dichlorophenyl)-2-propenylidenemalononitrile;2-(3-(2,6-Dichlorophenyl)-2-propenylidene)malononitrile

Chemical Property of 2,6-Dichlorocinnamylidenemalononitrile

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 247.9908036
• Heavy Atom Count: 16
• Complexity: 366

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)C=CC=C(C#N)C#N)Cl
• Isomeric SMILES: C1=CC(=C(C(=C1)Cl)/C=C/C=C(C#N)C#N)Cl