Basic information
- CAS
879-67-4- Standard SMILES
COc1cc(C)ccc1OC(C)=O- InChIKey
OMYVQMNBUXUYLM-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- Phenol, 2-methoxy-4-methyl-, 1-acetate
- IUPAC
- (2-methoxy-4-methylphenyl) acetate
- English name
- 2-methoxy-p-tolyl acetate
- Molecular formula
- C10H12O3
- Molecular weight
- 180.2
Names & synonyms
2-Methoxy-p-tolyl acetatep-Cresol, 2-methoxy-, acetate2-Methoxy-p-cresol acetatePhenol, 2-methoxy-4-methyl-, acetatePhenol, 2-methoxy-4-methyl-, 1-acetateEINECS 212-908-6DTXSID90862457RefChem:860856DTXCID80811217212-908-6879-67-42-methoxy-4-methylphenyl acetate
Show more names
2-methoxy-para-tolyl acetate2-Methoxy-4-methylphenol acetate2-methoxy-4-methyl-pheno acetatePhenol, 2-methoxy-4-methyl, acetateAcetic acid 2-methoxy-4-methylphenyl ester
(2-methoxy-4-methylphenyl) acetatecreosol acetateSCHEMBL171836SCHEMBL4410176OMYVQMNBUXUYLM-UHFFFAOYSA-NMFCD30214972NS00042237H80087
Database identifiers
- CAS
879-67-4- PubChem CID
- 70149
- DTXSID
DTXSID90862457- EC Number
- 212-908-6
- Nikkaji
- J195.173D
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 179
Physicochemical properties
- Boiling point
- 231.1 · 231.1±20.0 °C(Predicted)
- Density
- 1.076 · 1.076±0.06 g/cm3(Predicted)
- LogP
- 2.231 · 2.231 (est)
- EPA Substance Registry System
- 2 · 2-Methoxy-p-cresol acetate (879-67-4)
- TSCA
- TSCA listed
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
This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.
Not Classified
Aggregated GHS information provided per 89 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: Phenol, 2-methoxy-4-methyl-, acetate
Other Safety InformationIMAP assessments - Phenol, 2-methoxy-4-methyl-, acetate: Environment tier I assessment
Hazard Classes and CategoriesNot Classified
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationPhenol, 2-methoxy-4-methyl-, 1-acetate: INACTIVE
Upstream & downstream products
Downstream products
Suppliers8 total
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 19370895928 · [email protected]
安徽合诺生物科技有限公司0555-2761852
山东利腾生物科技有限公司+86-18663721413 +86-15552573001 · [email protected]
安徽合诺生物科技有限公司18455579438
山东利腾生物科技有限公司15020019777 18663721413 · [email protected]
上海问彩新材料科技有限公司15721586846 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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