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N-(2,4-dichlorobenzoyl)-3,4,5,6-tetrachlorophthalimide

HCID 21546572
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Basic information

Standard SMILES
O=C(c1ccc(Cl)cc1Cl)N1C(=O)c2c(Cl)c(Cl)c(Cl)c(Cl)c2C1=O
InChIKey
AZORQKCLOXJBJQ-UHFFFAOYSA-N
Molecular formula
C15H3Cl6NO3
Average molar mass
457.9 g/mol
Monoisotopic mass
454.824409

Names & identifiers

Preferred name
N-(2,4-dichlorobenzoyl)-3,4,5,6-tetrachlorophthalimide
IUPAC
4,5,6,7-tetrachloro-2-(2,4-dichlorobenzoyl)isoindole-1,3-dione

Names & synonyms

SCHEMBL11821257AZORQKCLOXJBJQ-UHFFFAOYSA-NN-(2,4-dichlorobenzoyl)-3,4,5,6-tetrachlorophthalimide

Database identifiers

PubChem CID
21546572

Properties

Computed structural properties

XLogP
6.1
Topological polar surface area
54.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
25
Formal charge
0
Complexity
572

Related reactions

2 records
New reaction record
HRID 1217281 reaction equation
HRID 1217281As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1605204 reaction equation
HRID 1605204As productuspto-grants-1976_04

Compound notes

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