5-Chloro-2-(2,4-dichlorophenoxy)phenyl 4-chloroformylbutyrate

HCID 53685136
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Basic information

Standard SMILES
O=C(Cl)CCCC(=O)Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
InChIKey
BJIVJTXPQHNZHV-UHFFFAOYSA-N
Molecular formula
C17H12Cl4O4
Average molar mass
422.1 g/mol
Monoisotopic mass
419.94897

Names & identifiers

Preferred name
5-Chloro-2-(2,4-dichlorophenoxy)phenyl 4-chloroformylbutyrate
IUPAC
[5-chloro-2-(2,4-dichlorophenoxy)phenyl] 5-chloro-5-oxopentanoate

Names & synonyms

SCHEMBL10882697BJIVJTXPQHNZHV-UHFFFAOYSA-N5-chloro-2-(2,4-dichlorophenoxy)phenyl 4-chloroformylbutyrate

Database identifiers

PubChem CID
53685136

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
52.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
25

Related reactions

2 records
New reaction record

Compound notes

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5-Chloro-2-(2,4-dichlorophenoxy)phenyl 4-chloroformylbutyrate (HCID 53685136)｜Huagongshe