Methyl 3,5-dimethoxyphenylacetate
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Basic information
- CAS
6512-32-9- Standard SMILES
COC(=O)Cc1cc(OC)cc(OC)c1- InChIKey
CLZWNNSTRIEAMH-UHFFFAOYSA-N- Molecular formula
- C11H14O4
- Average molar mass
- 210.23 g/mol
- Monoisotopic mass
- 210.08920893
Names & identifiers
- Preferred name
- Methyl 3,5-dimethoxyphenylacetate
- IUPAC
- methyl 2-(3,5-dimethoxyphenyl)acetate
- English name
- 3,5-Dimethoxyphenylacetic acid methyl ester
- Molecular formula
- C11H14O4
- Molecular weight
- 210.23
Names & synonyms
6512-32-9methyl 3,5-dimethoxyphenylacetateRefChem:814677664-864-6methyl 2-(3,5-dimethoxyphenyl)acetate3,5-dimethoxyphenylacetic acid methyl esterMethyl (3,5-dimethoxyphenyl)acetateBenzeneacetic acid,3,5-dimethoxy-, methyl esterMFCD00089971(3,5-Dimethoxyphenyl)acetic acid methyl esterMethyl (3,5-dimethoxyphenyl)acetate #BS-43768
Show more names
Ethyl 3,5-diMethoxyphenylacetate
M2933Benzeneacetic acid, 3,5-dimethoxy-, methyl esterMETHYL-3,5-DIMETHOXYPHENYLACETATEFT-07235073,5-DIMETHOXYPHENYLACETICACIDMETHYLESTER(3,5-dimSCHEMBL348963CLZWNNSTRIEAMH-UHFFFAOYSA-
Database identifiers
- CAS
6512-32-9- PubChem CID
- 592191
- DTXSID
DTXSID901382224- EC Number
- 664-864-6
- Nikkaji
- J1.802.596E
Properties
Computed structural propertiesFilling in
- XLogP
- 1.7
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 94 °C/0.04mmHg · 94°C/0.04mmHg(lit.)
- Density
- 1.105 · 1.105±0.06 g/cm3(Predicted)
- refractive index
- 1.52 to · 1.5200 to 1.5240
- storage temp.
- Sealed in dry,Room Temperature
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly)
- form
- Oil
- color
- Colourless
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 319 · H319-H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P
- HS Code
- 2918990090 · 2918990090
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
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, 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. 3 (100%)
Safety data
- hs_code
- 2918990090
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H319-H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501-P264-P280-P305+P351+P338-P337+P313P
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
13 records
Compound notes
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