Basic information
- CAS
65535-51-5- Standard SMILES
CC(=O)Oc1c(OCc2ccccc2)ccc2ccc(=O)oc12- InChIKey
LYKLLKLYWAPZJJ-UHFFFAOYSA-N- Molecular formula
- C18H14O5
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.08412354
Names & identifiers
- Preferred name
- 7-(Benzyloxy)-2-oxo-2H-1-benzopyran-8-yl acetate
- IUPAC
- (2-oxo-7-phenylmethoxychromen-8-yl) acetate
Names & synonyms
65535-51-57-(Benzyloxy)-2-oxo-2H-1-benzopyran-8-yl acetateDTXSID20555921
Database identifiers
- CAS
65535-51-5- PubChem CID
- 14101448
- DTXSID
DTXSID20555921
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 61.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 466
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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