(6E)-4-chloro-6-[1-(2,5-dichloroanilino)ethylidene]cyclohexa-2,4-dien-1-one
Basic information
- CAS
5354-40-5- Standard SMILES
CC(=Nc1cc(Cl)ccc1Cl)c1cc(Cl)ccc1O- InChIKey
VVNIAIJURSISMC-UHFFFAOYSA-N- Molecular formula
- C14H10Cl3NO
- Average molar mass
- 314.6 g/mol
- Monoisotopic mass
- 312.982797
Names & identifiers
- Preferred name
- (6E)-4-chloro-6-[1-(2,5-dichloroanilino)ethylidene]cyclohexa-2,4-dien-1-one
- IUPAC
- 4-chloro-2-[N-(2,5-dichlorophenyl)-C-methylcarbonimidoyl]phenol
Names & synonyms
5354-40-5AC1NSEU1Oprea1_865750DTXSID70416391(6E)-4-chloro-6-[1-(2,5-dichloroanilino)ethylidene]cyclohexa-2,4-dien-1-one
Database identifiers
- CAS
5354-40-5- PubChem CID
- 779730
- DTXSID
DTXSID70416391
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 337
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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