Basic information
- CAS
4934-55-8- Standard SMILES
Cc1cc(C(=O)c2ccccc2)ccc1N- InChIKey
ZCVUMNJAVAXADT-UHFFFAOYSA-N- Molecular formula
- C14H13NO
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.09971404
Names & identifiers
- Preferred name
- Benzophenone, 4-amino-3-methyl-
- IUPAC
- (4-amino-3-methylphenyl)-phenylmethanone
- English name
- 4-Amino-3-methylbenzophenone
- Molecular formula
- C14H13NO
- Molecular weight
- 211.26
Names & synonyms
4-Amino-3-methylbenzophenone4934-55-83-Methyl-4-aminobenzophenoneBENZOPHENONE, 4-AMINO-3-METHYL-3-Metil-4-ammino-benzofenoneBRN 21004223-Metil-4-ammino-benzofenone [Italian]Methanone, (4-amino-3-methylphenyl)phenyl-DTXSID101977733-14-00-00245 (Beilstein Handbook Reference)RefChem:328146DTXCID70120264
Show more names
(4-Amino-3-methylphenyl)(phenyl)methanoneSCHEMBL4609604ZCVUMNJAVAXADT-UHFFFAOYSA-NAKOS013511822DB-131016
Database identifiers
- CAS
4934-55-8- PubChem CID
- 21052
- DTXSID
DTXSID10197773- Nikkaji
- J80.926H
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
Physicochemical properties
- Melting point
- 113 °C · 113 °C
- Boiling point
- 395.7 · 395.7±35.0 °C(Predicted)
- Density
- 1.135 · 1.135±0.06 g/cm3(Predicted)
- pka
- 2.03 · 2.03±0.10(Predicted)
Related reactions
5 records
Compound notes
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