Basic information
- CAS
648442-54-0- Standard SMILES
Cc1c2oc(=O)cc(CCCC(=O)O)c2cc2c(-c3ccccc3)coc12- InChIKey
IXEVFFSPZRUGFR-UHFFFAOYSA-N- Molecular formula
- C22H18O5
- Average molar mass
- 362.4 g/mol
- Monoisotopic mass
- 362.11542367
Names & identifiers
- Preferred name
- 7H-Furo[3,2-g][1]benzopyran-5-butanoic acid, 9-methyl-7-oxo-3-phenyl-
- IUPAC
- 4-(9-methyl-7-oxo-3-phenylfuro[3,2-g]chromen-5-yl)butanoic acid
Names & synonyms
648442-54-07H-Furo[3,2-g][1]benzopyran-5-butanoic acid, 9-methyl-7-oxo-3-phenyl-DTXSID604559914-(9-Methyl-7-oxo-3-phenyl-7H-furo[3,2-g][1]benzopyran-5-yl)butanoic acid
Database identifiers
- CAS
648442-54-0- PubChem CID
- 11122012
- DTXSID
DTXSID60455991
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 606
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…