Ethyl (2E)-2-(diethoxycarbonyl)-3-(4-methylphenyl)prop-2-enoate
Basic information
- CAS
14656-24-7- Standard SMILES
CCOC(=O)/C(=C\c1ccc(C)cc1)P(=O)(OCC)OCC- InChIKey
JGCLOKQRUSPYRU-NTCAYCPXSA-N- Molecular formula
- C16H23O5P
- Average molar mass
- 326.32 g/mol
- Monoisotopic mass
- 326.12831083
Names & identifiers
- Preferred name
- Ethyl (2E)-2-(diethoxycarbonyl)-3-(4-methylphenyl)prop-2-enoate
- IUPAC
- ethyl (E)-2-diethoxyphosphoryl-3-(4-methylphenyl)prop-2-enoate
Names & synonyms
NSC 102263Ethyl (2E)-2-(diethoxycarbonyl)-3-(4-methylphenyl)prop-2-enoate14656-24-7NSC102263ethyl (E)-2-diethoxyphosphoryl-3-(p-tolyl)prop-2-enoate
Database identifiers
- CAS
14656-24-7- PubChem CID
- 5380653
- Nikkaji
- J1.302.082E
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 414
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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