N-[4-chloro-2-fluoro-5-(1-methoxyethyl)phenyl]-3,4,5,6-tetrahydrophthalimide

HCID 20032354
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Basic information

Standard SMILES
COC(C)c1cc(N2C(=O)C3=C(CCCC3)C2=O)c(F)cc1Cl
InChIKey
DIMPXPFOEFDMPO-UHFFFAOYSA-N
Molecular formula
C17H17ClFNO3
Average molar mass
337.8 g/mol
Monoisotopic mass
337.0880993

Names & identifiers

Preferred name
N-[4-chloro-2-fluoro-5-(1-methoxyethyl)phenyl]-3,4,5,6-tetrahydrophthalimide
IUPAC
2-[4-chloro-2-fluoro-5-(1-methoxyethyl)phenyl]-4,5,6,7-tetrahydroisoindole-1,3-dione

Names & synonyms

SCHEMBL10573139DIMPXPFOEFDMPO-UHFFFAOYSA-NN-[4-chloro-2-fluoro-5-(1-methoxyethyl)phenyl]-3,4,5,6-tetrahydrophthalimide

Database identifiers

PubChem CID
20032354

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
23

Related reactions

1 records
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Compound notes

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