Basic information
- CAS
7378-50-9- Standard SMILES
CN(C)c1ccc(C=Cc2ccc(Cl)cc2)cc1- InChIKey
OKQSWCXNELJRIO-UHFFFAOYSA-N- Molecular formula
- C16H16ClN
- Average molar mass
- 257.76 g/mol
- Monoisotopic mass
- 257.0971272
Names & identifiers
- Preferred name
- 4'-Chloro-4-dimethylaminostilbene
- IUPAC
- 4-[2-(4-chlorophenyl)ethenyl]-N,N-dimethylaniline
- English name
- 4-[2-(4-Chlorophenyl)ethenyl]-N,N-dimethylaniline
- Molecular formula
- C16H16ClN
- Molecular weight
- 257.76
Names & synonyms
7378-50-94'-Chloro-4-dimethylaminostilbene4'-Chloro-N,N-dimethyl-4-stilbenamineStilbenamine, 4'-chloro-N,N-dimethyl-4'-Chloro-4-stilbenyl-N,N-dimethylamine4'-Chloro-N,N-dimethylaminostiben [German]4-[2-(4-chlorophenyl)ethenyl]-N,N-dimethylanilineSCHEMBL9822810DTXSID009947184'-Chloro-N,N-dimethylaminostiben4-[2-(4-Chlorophenyl)ethen-1-yl]-N,N-dimethylaniline-CHLORO-N,N-DIMETHYL-4-STILBENAMINE
Database identifiers
- CAS
7378-50-9- PubChem CID
- 94337
- DTXSID
DTXSID00994718
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 258
Physicochemical properties
- Melting point
- 229 °C · 229 °C
- Boiling point
- 404.63 °C · 404.63°C (rough estimate)
- Density
- 1.0956 · 1.0956 (rough estimate)
- refractive index
- 1.5868 · 1.5868 (estimate)
- pka
- 4.326 · 4.326±0.15(predicted)
Chemistry & industry
Suppliers1 total
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…