Basic information
- CAS
57598-00-2- Standard SMILES
Cc1cc(N=Nc2ccccc2C)ccc1O- InChIKey
MFPXPIPAPXYRTJ-UHFFFAOYSA-N- Molecular formula
- C14H14N2O
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.11061307
Names & identifiers
- Preferred name
- o-CRESOL, p-(o-TOLYLAZO)-
- IUPAC
- 2-methyl-4-[(2-methylphenyl)diazenyl]phenol
- English name
- 4-(o-Tolylazo)-2-methylphenol
- Molecular formula
- C14H14N2O
- Molecular weight
- 226.27
Names & synonyms
o-CRESOL, p-(o-TOLYLAZO)-4'-Hydroxy-2,3'-azotolueneBRN 353089257598-00-24-16-00-00194 (Beilstein Handbook Reference)SCHEMBL28912118(e)-2-methyl-4-(o-tolyldiazenyl)phenol4-(o-Tolylazo)-o-cresol4-(o-Tolylazo)-2-methylphenolPhenol, 2-methyl-4-[2-(2-methylphenyl)diazenyl]-
Database identifiers
- CAS
57598-00-2- PubChem CID
- 42480
- Nikkaji
- J118.442C
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 267
Physicochemical properties
- Melting point
- 132 °C · 132°C
- Boiling point
- 367.89 °C · 367.89°C (rough estimate)
- Density
- 1.0852 · 1.0852 (rough estimate)
- refractive index
- 1.6419 · 1.6419 (estimate)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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