8-(Bromomethyl)-4-methyl-2H-furo[2,3-h][1]benzopyran-2-one
Basic information
- CAS
139395-82-7- Standard SMILES
Cc1cc(=O)oc2c1ccc1oc(CBr)cc12- InChIKey
MJBQOIZNCDJDLW-UHFFFAOYSA-N- Molecular formula
- C13H9BrO3
- Average molar mass
- 293.11 g/mol
- Monoisotopic mass
- 291.97351
Names & identifiers
- Preferred name
- 8-(Bromomethyl)-4-methyl-2H-furo[2,3-h][1]benzopyran-2-one
- IUPAC
- 8-(bromomethyl)-4-methylfuro[2,3-h]chromen-2-one
Names & synonyms
139395-82-78-(BROMOMETHYL)-4-METHYL-2H-FURO[2,3-H]CHROMEN-2-ONE8-(Bromomethyl)-4-methyl-2H-furo[2,3-h][1]benzopyran-2-oneDTXSID00513529
Database identifiers
- CAS
139395-82-7- PubChem CID
- 12940934
- DTXSID
DTXSID00513529- Nikkaji
- J425.418J
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 39.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…