Basic information
- Standard SMILES
CCOCc1cc(N2C(=O)C3=C(CCCC3)C2=O)c(F)cc1Br- InChIKey
AAJNBHMHFXIMJE-UHFFFAOYSA-N- Molecular formula
- C17H17BrFNO3
- Average molar mass
- 382.2 g/mol
- Monoisotopic mass
- 381.03758
Names & identifiers
- Preferred name
- N-(4-bromo-2-fluoro-5-ethoxymethylphenyl)-3,4,5,6-tetrahydrophthalimide
- IUPAC
- 2-[4-bromo-5-(ethoxymethyl)-2-fluorophenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione
Names & synonyms
SCHEMBL10573086AAJNBHMHFXIMJE-UHFFFAOYSA-NN-(4-bromo-2-fluoro-5-ethoxymethylphenyl)-3,4,5,6-tetrahydrophthalimide
Database identifiers
- PubChem CID
- 14501845
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 508
Related reactions
1 records
Compound notes
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