3-(1,1-Difluoroallyl)-7-methoxyquinoxalin-2-ol
Basic information
- CAS
1535210-93-5- Standard SMILES
C=CC(F)(F)c1nc2ccc(OC)cc2[nH]c1=O- InChIKey
DIMKZJCEDAOBRC-UHFFFAOYSA-N- Molecular formula
- C12H10F2N2O2
- Average molar mass
- 252.22 g/mol
- Monoisotopic mass
- 252.07103389
Names & identifiers
- Preferred name
- 3-(1,1-Difluoroallyl)-7-methoxyquinoxalin-2-ol
- IUPAC
- 3-(1,1-difluoroprop-2-enyl)-7-methoxy-1H-quinoxalin-2-one
Names & synonyms
3-(1,1-Difluoroallyl)-7-methoxyquinoxalin-2-ol1535210-93-53-(1,1-difluoroprop-2-en-1-yl)-7-methoxyquinoxalin-2-ol3-(1,1-difluoroprop-2-enyl)-7-methoxy-1H-quinoxalin-2-oneSCHEMBL15423623DIMKZJCEDAOBRC-UHFFFAOYSA-NDTXSID901186054F508463-(1,1-Difluoro-2-propen-1-yl)-7-methoxy-2(1H)-quinoxalinone3-(1,1-Difluoroprop-2-en-1-yl)-7-methoxyquinoxalin-2(1H)-one
Database identifiers
- CAS
1535210-93-5- PubChem CID
- 89929622
- DTXSID
DTXSID901186054
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 396
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