2,4-Dichloro-1-(4-chlorobutoxy)benzene

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Basic information

CAS: 23468-04-4
Standard SMILES: ClCCCCOc1ccc(Cl)cc1Cl
InChIKey: GDPYRIBOKVQSET-UHFFFAOYSA-N
Molecular formula: C10H11Cl3O
Average molar mass: 253.5 g/mol
Monoisotopic mass: 251.987548

Names & identifiers

Preferred name: 2,4-Dichloro-1-(4-chlorobutoxy)benzene
IUPAC: 2,4-dichloro-1-(4-chlorobutoxy)benzene

Names & synonyms

23468-04-42,4-dichloro-1-(4-chlorobutoxy)benzeneSCHEMBL9214093DTXSID401034404AKOS0110201111-chloro-4-(2,4-dichlorophenoxy)-butaneBenzene, 2,4-dichloro-1-(4-chlorobutoxy)-

Database identifiers

CAS: 23468-04-4
PubChem CID: 12928635
DTXSID: DTXSID401034404
Nikkaji: J1.581.990A

Properties

Computed structural properties

XLogP: 5
Topological polar surface area: 9.2 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 5
Heavy atoms: 14
Formal charge: 0
Complexity: 154

Related reactions

1 records

New reaction record

HRID 1682036As reactantuspto-grants-1992_12

Compound notes

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