Basic information
- CAS
33721-62-9- Standard SMILES
CCc1ccc(N=Cc2ccccc2O)cc1- InChIKey
OLUGVEIBZJDJFG-UHFFFAOYSA-N- Molecular formula
- C15H15NO
- Average molar mass
- 225.28 g/mol
- Monoisotopic mass
- 225.1153641
Overview
See also: Alpha-(4-ethylphenylimino)-O-cresol (annotation moved to).
Names & identifiers
- Preferred name
- (6E)-6-[(4-ethylanilino)methylidene]cyclohexa-2,4-dien-1-one
- IUPAC
- 2-[(4-ethylphenyl)iminomethyl]phenol
- English name
- alpha-(4-Ethylphenylimino)-o-cresol
- Molecular formula
- C15H15NO
- Molecular weight
- 225.29
Names & synonyms
33721-62-9AC1NTE9BNSC132532(6E)-6-[(4-ethylanilino)methylidene]cyclohexa-2,4-dien-1-oneOprea1_191028Oprea1_839859DTXSID80419974STK900216AKOS003632633AKOS005648497NSC-1325322-{(E)-[(4-ethylphenyl)imino]methyl}phenol
Show more names
alpha-(4-Ethylphenylimino)-o-cresolPhenol, 2-[[(4-ethylphenyl)imino]methyl]-
2-{(Z)-[(4-ethylphenyl)imino]methyl}phenol
Database identifiers
- CAS
33721-62-9- PubChem CID
- 280653
- DTXSID
DTXSID80419974- Nikkaji
- J1.529.457D
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 243
Physicochemical properties
- Boiling point
- 380.5 · 380.5±35.0 °C(Predicted)
- Density
- 1.03 · 1.03±0.1 g/cm3(Predicted)
- pka
- 8.47 · 8.47±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H411-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H315-H335-H411-H319
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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