Basic information
- CAS
3246-73-9- Standard SMILES
Cc1ccccc1N=Cc1ccccc1O- InChIKey
CSHNLQILGOBKMX-UHFFFAOYSA-N- Molecular formula
- C14H13NO
- Average molar mass
- 211.26 g/mol
- Monoisotopic mass
- 211.09971404
Names & identifiers
- Preferred name
- Alpha-(O-tolylimino)-O-cresol
- IUPAC
- 2-[(2-methylphenyl)iminomethyl]phenol
- English name
- 2-((o-Tolylimino)methyl)phenol
- Molecular formula
- C14H13NO
- Molecular weight
- 211.26
Names & synonyms
ALPHA-(O-TOLYLIMINO)-O-CRESOLRefChem:555324665-852-33246-73-92-{(E)-[(2-methylphenyl)imino]methyl}phenolNSC100881Salicyliden-o-toluidin2-{[(2-methylphenyl)imino]methyl}phenolNCIOpen2_0068912-(o-Tolyliminomethyl)phenolSCHEMBL802042SCHEMBL1947963
Show more names
N-salicylidene-o-methylaniline2-((o-Tolylimino)methyl)phenolPhenol, 2-[[(2-methylphenyl)imino]methyl]-
SCHEMBL12566830SCHEMBL30970907CSHNLQILGOBKMX-XNTDXEJSSA-NSTK078588AKOS003672248N-2-Hydroxybenzylidene-2-methylanilineNSC-100881AE-641/02437052
Database identifiers
- CAS
3246-73-9- PubChem CID
- 265083
- EC Number
- 665-852-3
- Nikkaji
- J1.205.873J
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
- 239
Physicochemical properties
- Melting point
- 40 °C · 40 °C
- Boiling point
- 136 · 136-139 °C(Press: 0.1 Torr)
- 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
- 335 · H335-H302-H319-H315
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H335-H302-H319-H315
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501-P264-P280-P302+P352-P321-P332+P313-P362
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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