2-[(2-Fluorophenyl)methyl]isoindole-1,3-dione
Basic information
- CAS
10253-07-3- Standard SMILES
O=C1c2ccccc2C(=O)N1Cc1ccccc1F- InChIKey
ZKHXRXJMCPSISR-UHFFFAOYSA-N- Molecular formula
- C15H10FNO2
- Average molar mass
- 255.24 g/mol
- Monoisotopic mass
- 255.06955672
Names & identifiers
- Preferred name
- 2-[(2-Fluorophenyl)methyl]isoindole-1,3-dione
- IUPAC
- 2-[(2-fluorophenyl)methyl]isoindole-1,3-dione
Names & synonyms
2-[(2-Fluorophenyl)methyl]-1H-isoindole-1,3(2H)-dione10253-07-32-[(2-fluorophenyl)methyl]isoindole-1,3-dioneMLS001173875SCHEMBL6679487CHEMBL1479006SCHEMBL29819864DTXSID101327367HMS2904L06AKOS022352714SMR000592798Z18271707
Database identifiers
- CAS
10253-07-3- PubChem CID
- 7688293
- DTXSID
DTXSID101327367- ChEMBL
CHEMBL1479006
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 360
Experimental & physicochemical properties
Solubility1.5 [ug/mL] (The mean of the results at pH 7.4)
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Compound notes
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