N-(pentachlorobenzoyl)-3,4-dibromohexahydrophthalimide

HCID 21542801
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Basic information

Standard SMILES
O=C(c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl)N1C(=O)C2CCC(Br)C(Br)C2C1=O
InChIKey
JQPZQKPTUHPELW-UHFFFAOYSA-N
Molecular formula
C15H8Br2Cl5NO3
Average molar mass
587.3 g/mol
Monoisotopic mass
582.73136

Names & identifiers

Preferred name
N-(pentachlorobenzoyl)-3,4-dibromohexahydrophthalimide
IUPAC
4,5-dibromo-2-(2,3,4,5,6-pentachlorobenzoyl)-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione

Names & synonyms

SCHEMBL11831320JQPZQKPTUHPELW-UHFFFAOYSA-NN-(pentachlorobenzoyl)-3,4-dibromohexahydrophthalimide

Database identifiers

PubChem CID
21542801

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
54.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
26

Related reactions

2 records
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Compound notes

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