Basic information
- CAS
117909-26-9- Standard SMILES
Cc1ccc(N=Cc2ccccc2O)cc1- InChIKey
LXHFZWNBMULGIO-UHFFFAOYSA-N- Molecular formula
- C14H13NO
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.09971404
Overview
See also: Alpha-(P-tolylimino)-ortho-cresol (annotation moved to).
Names & identifiers
- Preferred name
- 2-[(E)-[(4-methylphenyl)imino]methyl]phenol
- IUPAC
- 2-[(4-methylphenyl)iminomethyl]phenol
- English name
- 2-{[(4-methylphenyl)imino]methyl}phenol
- Molecular formula
- C14H13NO
- Molecular weight
- 211.26
Names & synonyms
782-76-3(E)-2-((p-tolylimino)methyl)phenol2-[(E)-[(4-methylphenyl)imino]methyl]phenol2-{[(4-methylphenyl)imino]methyl}phenolXanthine oxidase-IN-132-[(4-methylphenyl)iminomethyl]phenolPhenol,2-[[(4-methylphenyl)imino]methyl]-2-((p-tolylimino)methyl)phenolMFCD001361562-[[(4-Methylphenyl)imino]methyl]phenol2-{(E)-[(4-methylphenyl)imino]methyl}phenol2-([(4-Methylphenyl)imino]methyl)phenol
Show more names
N-Salicylidene-p-toluidinePhenol, 2-[[(4-methylphenyl)imino]methyl]-
2-(p-tolyliminomethyl)phenolNSC99418p-TolylsalicylaldimineN-p-TolylsalicylaldimineN-p-TolylsalicylideneamineSalicylidene-p-methylanilineLumogen yellow 554(562)SCHEMBL2603636
Database identifiers
- CAS
117909-26-9、782-76-3- PubChem CID
- 264356
- DTXSID
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 32.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 231
Experimental & physicochemical properties
Chemical ClassesAlkylphenol
Physicochemical properties
- Melting point
- 151 °C · 151 °C
- Boiling point
- 370.7 · 370.7±35.0 °C(Predicted)
- Density
- 1.04 · 1.04±0.1 g/cm3(Predicted)
- pka
- 8.47 · 8.47±0.30(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H335-H319-H302
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
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
- Hazard statements
- H315-H335-H319-H302
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
ZERENEX[email protected]
SIGMAALDRICH—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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