Basic information
- Standard SMILES
CCOC=C(C(=O)OCC)C(=O)c1ccccc1- InChIKey
YAHUDNWHZFLCBN-UHFFFAOYSA-N- Molecular formula
- C14H16O4
- Average molar mass
- 248.27 g/mol
- Monoisotopic mass
- 248.10485899
Names & identifiers
- Preferred name
- Ethyl 2-benzoyl-3-ethoxyacrylate
- IUPAC
- ethyl 2-benzoyl-3-ethoxyprop-2-enoate
Names & synonyms
Ethyl 2-benzoyl-3-ethoxyacrylate39973-76-7ethyl 2-benzoyl-3-ethoxyprop-2-enoateSCHEMBL995358ethyl ethoxymethylenebenzoylacetateDTXSID101238031ethyl 2-benzoyl-3-ethoxy-2-propenoate2-benzoyl-3-ethoxy-acrylic acid ethyl esterethoxymethylene benzoyl acetic acid ethyl esterEthyl I+/--(ethoxymethylene)-I(2)-oxobenzenepropanoate
Database identifiers
- CAS
39973-76-7- PubChem CID
- 98006
- DTXSID
DTXSID101238031- EC Number
- 254-723-3
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 314
Related reactions
12 records
Linked notes
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