Basic information
- CAS
7116-39-4- Standard SMILES
CCOC(=O)CCc1cccc(OC)c1- InChIKey
JKUZROGLCCUHCK-UHFFFAOYSA-N- Molecular formula
- C12H16O3
- Average molar mass
- 208.25 g/mol
- Monoisotopic mass
- 208.10994437
Names & identifiers
- Preferred name
- Ethyl 3-(3-methoxyphenyl)propanoate
- IUPAC
- ethyl 3-(3-methoxyphenyl)propanoate
- English name
- 3-(3-METHOXY-PHENYL)-PROPIONIC ACID ETHYL ESTER
- Molecular formula
- C12H16O3
- Molecular weight
- 208.25
Names & synonyms
Ethyl 3-(3-methoxyphenyl)propanoate7116-39-4MFCD077729573-(3-Methoxyphenyl)propionic acid ethyl ester3-(3-Methoxy-phenyl)-propionic acid ethyl esterEthyl3-(3-methoxyphenyl)propanoateSCHEMBL1802183DTXSID90342769ethyl 3-(3-methoxyphenyl)propionateAKOS009166769Ethyl 3-(3-methoxyphenyl)propanoate #AS-62296
Show more names
3-(M-Methoxyphenyl)propionateEthyl 3-methoxybenzenepropanoateethyl 3-(3-Methoxylphenyl)propanoate3-(3-Methoxyphenyl)propanoic acid ethyl esterBenzenepropanoic acid, 3-methoxy-, ethyl ester
SY3355503-Methoxy-benzenepropanoic acid ethyl esterDB-251798CS-0312961D86271F720647
Database identifiers
- CAS
7116-39-4- PubChem CID
- 584318
- DTXSID
DTXSID90342769- Nikkaji
- J526.448K
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 191
Physicochemical properties
- Boiling point
- 156 · 156-157 °C(Press: 15 Torr)
- Density
- 1.045 · 1.045±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-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
- P261-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers10 total
上海景颜化工科技有限公司13817811078 · [email protected]
Labnetwork lnc.+86-27-50766799 +86-18062016861 · [email protected]
上海创焰化学科技有限公司021-11111111 11111111111 · [email protected]
北京建强伟业科技有限公司（FUSION弗珍试剂品牌）0531-88924771 15614660963 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
江苏艾康生物医药研发有限公司025-58851090 13913916777 · [email protected]
上海凯为化学科技有限公司021-58461859 15821823057 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
禹州焓碳医药科技有限公司19963477321; 19963477321 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
7 records
Compound notes
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