3,5-Dichloro-4-cyanobenzoyl chloride

HCID 19087885
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Basic information

Standard SMILES
N#Cc1c(Cl)cc(C(=O)Cl)cc1Cl
InChIKey
CCCZJWIXSIYWLY-UHFFFAOYSA-N
Molecular formula
C8H2Cl3NO
Average molar mass
234.5 g/mol

Names & identifiers

Preferred name
3,5-Dichloro-4-cyanobenzoyl chloride
IUPAC
3,5-dichloro-4-cyanobenzoyl chloride

Names & synonyms

SCHEMBL9099466CCCZJWIXSIYWLY-UHFFFAOYSA-N3,5-dichloro-4-cyanobenzoyl chloride4-cyano-3,5-dichlorobenzoyl chlorideAKOS005061301

Database identifiers

PubChem CID
19087885

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
40.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
13

Related reactions

1 records
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Linked notes

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