1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-
Basic information
- CAS
35728-03-1- Standard SMILES
N#Cc1c(Cl)c(C#N)c(Nc2ccc(Cl)c(Cl)c2)c(C#N)c1Cl- InChIKey
SAFCEOPCBZQJEY-UHFFFAOYSA-N- Molecular formula
- C15H4Cl4N4
- Average molar mass
- 382 g/mol
- Monoisotopic mass
- 379.919007
Names & identifiers
- Preferred name
- 1,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-
- IUPAC
- 2,4-dichloro-6-(3,4-dichloroanilino)benzene-1,3,5-tricarbonitrile
- English name
- 2,4-Dichloro-6-[(3,4-dichlorophenyl)amino]-1,3,5-benzenetricarbonitrile
- Molecular formula
- C15H4Cl4N4
- Molecular weight
- 382.03
Names & synonyms
35728-03-1BRN 27848301,3,5-Benzenetricarbonitrile, 4,6-dichloro-2-(3,4-dichloroanilino)-4,6-Dichloro-2-(3,4-dichloroanilino)trimesonitrileDTXSID701892704,6-Dichloro-2-(3,4-dichloroanilino)-1,3,5-benzenetricarbonitrileRefChem:217153DTXCID001117612,4-dichloro-6-(3,4-dichloroanilino)benzene-1,3,5-tricarbonitrileCHEMBL32481772,4-Dichloro-6-[(3,4-dichlorophenyl)amino]-1,3,5-benzenetricarbonitrile1,3,5-Benzenetricarbonitrile, 2,4-dichloro-6-[(3,4-dichlorophenyl)amino]-
Database identifiers
- CAS
35728-03-1- PubChem CID
- 215477
- DTXSID
DTXSID70189270- ChEMBL
CHEMBL3248177- Nikkaji
- J41.334H
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 83.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 554
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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