Basic information
- Standard SMILES
O=C1NCc2c(-c3ccccc3)ccc(I)c21- InChIKey
MJABDDWVUUCMEU-UHFFFAOYSA-N- Molecular formula
- C14H10INO
- Average molar mass
- 335.14 g/mol
- Monoisotopic mass
- 334.98071
Names & identifiers
- Preferred name
- 1h-Isoindol-1-one,2,3-dihydro-7-iodo-4-phenyl-
- IUPAC
- 7-iodo-4-phenyl-2,3-dihydroisoindol-1-one
Names & synonyms
1h-isoindol-1-one,2,3-dihydro-7-iodo-4-phenyl-7-iodo-4-phenylisoindolinone866767-13-7SCHEMBL3039949MJABDDWVUUCMEU-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 68489346
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 301
Related reactions
2 records
Compound notes
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