Basic information
- CAS
102667-39-0- Standard SMILES
Cc1ccc(N(c2ccccc2)c2ccc(C=Cc3cc(C)cc(C)c3)cc2)cc1- InChIKey
OZCRDPVDPNFSLM-UHFFFAOYSA-N- Molecular formula
- C29H27N
- Average molar mass
- 389.5 g/mol
- Monoisotopic mass
- 389.21434987
Overview
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Names & identifiers
- Preferred name
- 4-[2-(3,5-Dimethylphenyl)ethenyl]-N-(4-methylphenyl)-N-phenylaniline
- IUPAC
- N-[4-[2-(3,5-dimethylphenyl)ethenyl]phenyl]-4-methyl-N-phenylaniline
- English name
- 4-(3,5-Dimethylstyryl)-N-phenyl-N-(4-methylphenyl)aniline
- Molecular formula
- C29H27N
- Molecular weight
- 389.53
Names & synonyms
SCHEMBL9156880DTXSID007022944-[2-(3,5-Dimethylphenyl)ethenyl]-N-(4-methylphenyl)-N-phenylaniline102667-39-04-[2-(3,5-Dimethylphenyl)ethen-1-yl]-N-(4-methylphenyl)-N-phenylaniline4-(3,5-Dimethylstyryl)-N-phenyl-N-(4-methylphenyl)aniline
Database identifiers
- CAS
102667-39-0- PubChem CID
- 53440010
- DTXSID
DTXSID00702294
Properties
Computed structural properties
- XLogP
- 8.5
- Topological polar surface area
- 3.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 506
Physicochemical properties
- Boiling point
- 555.345 · 555.345±50.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.105 · 1.105±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- -2.423 · -2.423±0.60(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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