Basic information
- Standard SMILES
C=CCC(CC=C)(C(=O)OC)c1ccccc1- InChIKey
ITMUKPMKRBVPLI-UHFFFAOYSA-N- Molecular formula
- C15H18O2
- Average molar mass
- 230.3 g/mol
- Monoisotopic mass
- 230.13067981
Names & identifiers
- Preferred name
- Methyl 2-allyl-2-phenyl-4-pentenoate
- IUPAC
- methyl 2-phenyl-2-prop-2-enylpent-4-enoate
Names & synonyms
SCHEMBL3999764ITMUKPMKRBVPLI-UHFFFAOYSA-NMethyl 2-allyl-2-phenyl-4-pentenoatemethyl 2-allyl-2-phenylpent-4-enoate
Database identifiers
- PubChem CID
- 11085592
- Nikkaji
- J1.173.523A
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 265
Related reactions
10 records
Compound notes
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