Basic information
- CAS
30988-43-3- Standard SMILES
Cc1ccc(N=CC(Cl)(Cl)Cl)cc1- InChIKey
IFEAMQCSFZCZAU-UHFFFAOYSA-N- Molecular formula
- C9H8Cl3N
- Average molar mass
- 236.5 g/mol
- Monoisotopic mass
- 234.972232
Names & identifiers
- Preferred name
- Benzenamine, 4-methyl-N-(2,2,2-trichloroethylidene)-
- IUPAC
- 2,2,2-trichloro-N-(4-methylphenyl)ethanimine
Names & synonyms
30988-43-3Benzenamine, 4-methyl-N-(2,2,2-trichloroethylidene)-2,2,2-trichloro-N-(4-methylphenyl)ethan-1-imineDTXSID50354303AKOS000511995AKOS021984355ST50216706(1E)-2,2,2-Trichloro-N-(4-methylphenyl)ethan-1-imine(1E)-3,3,3-trichloro-1-(4-methylphenyl)-1-azaprop-1-ene(1Z)-2,2,2-TRICHLORO-N-(4-METHYLPHENYL)ETHAN-1-IMINE
Database identifiers
- CAS
30988-43-3- PubChem CID
- 768243
- DTXSID
DTXSID50354303- Nikkaji
- J1.083.711A
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 12.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 178
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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