4-(3-Phenylphenyl)aniline
Basic information
- CAS
5728-67-6- Standard SMILES
Nc1ccc(-c2cccc(-c3ccccc3)c2)cc1- InChIKey
GBFUPSUZCKMTBK-UHFFFAOYSA-N- Molecular formula
- C18H15N
- Average molar mass
- 245.3 g/mol
- Monoisotopic mass
- 245.12044948
Names & identifiers
- Preferred name
- 4-(3-Phenylphenyl)aniline
- IUPAC
- 4-(3-phenylphenyl)aniline
- English name
- [1,1':3',1''-Terphenyl]-4-amine
- Molecular formula
- C18H15N
- Molecular weight
- 245.32
Names & synonyms
5728-67-64-(3-phenylphenyl)aniline[1,1':3',1''-Terphenyl]-4-aminem-terphenyl-4-amineNSC506439SCHEMBL7995315SCHEMBL14565868DTXSID60325423NSC 506439NSC-506439AS-94551H63919
Show more names
m-Terphenyl-4-amine (7CI,8CI)1,1':3',1''-Terphenyl]-4-amine
EN300-1585811AE-562/43458171[1~1~,2~1~:2~3~,3~1~-Terphenyl]-1~4~-amine
Database identifiers
- CAS
5728-67-6- PubChem CID
- 350071
- DTXSID
DTXSID60325423
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 26 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 261
Physicochemical properties
- Melting point
- 74 °C · 74 °C(Solv: ethanol, 95% (64-17-5))
- Boiling point
- 421.2 · 421.2±14.0 °C(Predicted)
- Density
- 1.103 · 1.103±0.06 g/cm3(Predicted)
- pka
- 4.25 · 4.25±0.10(Predicted)
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Related reactions
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Compound notes
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