Basic information
- CAS
75241-31-5- Standard SMILES
COc1cc(C=Nc2cc(C)ccc2C)ccc1O- InChIKey
BZTDQYJCKYTHMO-UHFFFAOYSA-N- Molecular formula
- C16H17NO2
- Average molar mass
- 255.31 g/mol
- Monoisotopic mass
- 255.12592879
Names & identifiers
- Preferred name
- N-Vanillylidene-2,5-xylidine
- IUPAC
- 4-[(2,5-dimethylphenyl)iminomethyl]-2-methoxyphenol
- English name
- N-Vanillylidene-2,5-xylidine
- Molecular formula
- C16H17NO2
- Molecular weight
- 255.31
Names & synonyms
75241-31-5n-vanillylidene-2,5-xylidineRefChem:831213652-144-44-(((2,5-Dimethylphenyl)imino)methyl)-2-methoxyphenol4-{[(2,5-dimethylphenyl)imino]methyl}-2-methoxyphenolBZTDQYJCKYTHMO-LICLKQGHSA-NSTK078644AKOS000484690ST45031289Phenol, 2-methoxy-4-(2,5-dimethylphenyliminomethyl)-4-((E)-[(2,5-Dimethylphenyl)imino]methyl)-2-methoxyphenol #
Show more names
Phenol, 4-[[(2,5-dimethylphenyl)imino]methyl]-2-methoxy-
4-[(1E)-2-(2,5-dimethylphenyl)-2-azavinyl]-2-methoxyphenol4-{(E)-[(2,5-dimethylphenyl)imino]methyl}-2-methoxyphenol
Database identifiers
- CAS
75241-31-5- PubChem CID
- 620472
- EC Number
- 652-144-4
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 41.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 305
Physicochemical properties
- Boiling point
- 429.3 · 429.3±45.0 °C(Predicted)
- Density
- 1.06 · 1.06±0.1 g/cm3(Predicted)
- pka
- 8.78 · 8.78±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H410-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-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.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H315-H319-H410-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362-P273-P391-P501
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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