Basic information
- CAS
87626-65-1- Standard SMILES
O=C(Cc1cccc2c(=O)cc(-c3ccccc3)oc12)OCCO- InChIKey
IDQZOKQCVMACAV-UHFFFAOYSA-N- Molecular formula
- C19H16O5
- Average molar mass
- 324.3 g/mol
- Monoisotopic mass
- 324.09977361
Names & identifiers
- Preferred name
- 2-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetate
- IUPAC
- 2-hydroxyethyl 2-(4-oxo-2-phenylchromen-8-yl)acetate
Names & synonyms
87626-65-1NSC347785DTXSID003195832-Hydroxyethyl (4-oxo-2-phenyl-4H-1-benzopyran-8-yl)acetateNSC-3477854H-1-Benzopyran-8-acetic acid, 2-hydroxyethyl ester
Database identifiers
- CAS
87626-65-1- PubChem CID
- 335877
- DTXSID
DTXSID00319583
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 492
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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