Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate
Basic information
- CAS
141333-27-9- Standard SMILES
CCOC(=O)CCCOc1ccc(C=O)cc1OC- InChIKey
YJRYCFVLCSZEAG-UHFFFAOYSA-N- Molecular formula
- C14H18O5
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.11542367
Names & identifiers
- Preferred name
- Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate
- IUPAC
- ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate
- English name
- Ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate
- Molecular formula
- C14H18O5
- Molecular weight
- 266.29
Names & synonyms
ethyl 4-(4-formyl-2-methoxyphenoxy)butanoate141333-27-9Butanoic acid, 4-(4-formyl-2-methoxyphenoxy)-, ethyl esterButanoic acid,4-(4-formyl-2-methoxyphenoxy)-, ethyl esterSCHEMBL7367306DTXSID30371558YJRYCFVLCSZEAG-UHFFFAOYSA-NAKOS008210434DB-3703644-(4-Formyl-2-methoxyphenoxy)butanoic acid, ethyl ester4- (4-Formyl-2-methoxyphenoxy)butanoic acid, ethyl ester
Database identifiers
- CAS
141333-27-9- PubChem CID
- 2736729
- DTXSID
DTXSID30371558
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 279
Physicochemical properties
- Boiling point
- 408.9 · 408.9±35.0 °C(Predicted)
- Density
- 1.132 · 1.132±0.06 g/cm3(Predicted)
Related reactions
4 records
Compound notes
Loading…