Basic information
- Standard SMILES
CC(=O)COc1ccc2ccc(=O)oc2c1- InChIKey
STOJMJQGRRERKR-UHFFFAOYSA-N- Molecular formula
- C12H10O4
- Average molar mass
- 218.2 g/mol
Names & identifiers
- Preferred name
- 7-(2-oxopropoxy)-2H-chromen-2-one
- IUPAC
- 7-(2-oxopropoxy)chromen-2-one
Names & synonyms
7-(2-oxopropoxy)-2H-chromen-2-one36914-75-77-(2-oxopropoxy)chromen-2-oneMFCD004498637-(2-oxopropoxy)-2H-1-benzopyran-2-one7-acetonyloxychromen-2-oneSCHEMBL8869879CHEMBL3740410STOJMJQGRRERKR-UHFFFAOYSA-NSTK371311AKOS001582089BS-37664
Show more names
DB-186458CS-0320204ST50450533SR-01000395945SR-01000395945-1
Database identifiers
- PubChem CID
- 766550
- ChEMBL
CHEMBL3740410- Nikkaji
- J764.483C
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 321
Related reactions
3 records
Compound notes
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