Basic information
- CAS
63196-44-1- Standard SMILES
CN1C(=O)c2ccc(F)cc2C1=O- InChIKey
DPYPKRLYESDBOK-UHFFFAOYSA-N- Molecular formula
- C9H6FNO2
- Average molar mass
- 179.15 g/mol
- Monoisotopic mass
- 179.0382566
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 5-fluoro-2-methyl-
- IUPAC
- 5-fluoro-2-methylisoindole-1,3-dione
Names & synonyms
63196-44-11H-Isoindole-1,3(2H)-dione, 5-fluoro-2-methyl-DTXSID80355045RefChem:239362DTXCID503061055-Fluoro-2-methylisoindoline-1,3-dione5-fluoro-2-methyl-1H-isoindole-1,3(2H)-dione5-fluoro-2-methyl-2,3-dihydro-1H-isoindole-1,3-dione5-fluoro-2-methylisoindole-1,3-dioneCambridge id 5238536SCHEMBL8417452AKOS003267426
Database identifiers
- CAS
63196-44-1- PubChem CID
- 790107
- DTXSID
DTXSID80355045
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 266
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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