3-Methoxybenzyl acetate
Basic information
- CAS
35480-26-3- Standard SMILES
COc1cccc(COC(C)=O)c1- InChIKey
AVTYLLXTBWFTSS-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- 3-Methoxybenzyl acetate
- IUPAC
- (3-methoxyphenyl)methyl acetate
- English name
- 3-Methoxybenzyl acetate
- Molecular formula
- C10H12O3
- Molecular weight
- 180.2
Names & synonyms
3-Methoxybenzyl acetate35480-26-3(3-methoxyphenyl)methyl acetateacetic acid 3-methoxy-benzyl ester3-methoxy-benzyl acetateM-METHOXYBENZYL ACETATESCHEMBL3147684DTXSID60875998Benzenemethanol, 3-methoxy-, acetateH52729Acetic acid m-methoxybenzyl esterAcetic acid 3-methoxybenzyl ester
Show more names
Benzenemethanol, 3-methoxy-, 1-acetate
Database identifiers
- CAS
35480-26-3- PubChem CID
- 586565
- DTXSID
DTXSID60875998- Nikkaji
- J155.588J
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 168
Experimental & physicochemical properties
LogP2.02
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
2 records
Compound notes
Loading…