Basic information
- CAS
21462-92-0- Standard SMILES
Cc1ccc(N=Nc2ccc(O)c(C)c2)cc1- InChIKey
RETCZAAFRITJJI-UHFFFAOYSA-N- Molecular formula
- C14H14N2O
- Average molar mass
- 226.27 g/mol
- Monoisotopic mass
- 226.11061307
Names & identifiers
- Preferred name
- 2-Methyl-4-[(4-methylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one
- IUPAC
- 2-methyl-4-[(4-methylphenyl)diazenyl]phenol
- English name
- 2-methyl-4-[(4-methylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-one
- Molecular formula
- C14H14N2O
- Molecular weight
- 226.27
Names & synonyms
21462-92-02-methyl-4-[(4-methylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-oneNSC83597DTXSID60418283NSC-835972-methyl-4-[(4-methylphenyl)diazenyl]phenol2-Methyl-4-[2-(4-methylphenyl)hydrazinylidene]cyclohexa-2,5-dien-1-onePhenol, 2-methyl-4-[2-(4-methylphenyl)diazenyl]-
Database identifiers
- CAS
21462-92-0- PubChem CID
- 256602
- DTXSID
DTXSID60418283- Nikkaji
- J2.070.020C
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 45 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Melting point
- 168 · 168-170 °C
- Boiling point
- 404.654 · 404.654±40.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.099 · 1.099±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.303 · 9.303±0.20(predicted)
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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