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3-[4-(4-Chlorophenoxy)-2-propylphenyl]-5-methoxy-1-benzofuran

HCID 68690334
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCc1cc(Oc2ccc(Cl)cc2)ccc1-c1coc2ccc(OC)cc12
InChIKey
GEPGPADGZYBJIZ-UHFFFAOYSA-N
Molecular formula
C24H21ClO3
Average molar mass
392.9 g/mol
Monoisotopic mass
392.1179222

Names & identifiers

Preferred name
3-[4-(4-Chlorophenoxy)-2-propylphenyl]-5-methoxy-1-benzofuran
IUPAC
3-[4-(4-chlorophenoxy)-2-propylphenyl]-5-methoxy-1-benzofuran

Names & synonyms

SCHEMBL3558380GEPGPADGZYBJIZ-UHFFFAOYSA-N3-[4-(4-chlorophenoxy)-2-propylphenyl]-5-methoxy-1-benzofuran

Database identifiers

PubChem CID
68690334

Properties

Computed structural properties

XLogP
7.4
Topological polar surface area
31.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
28
Formal charge
0
Complexity
478

Related reactions

3 records
New reaction record
HRID 1172814 reaction equation
HRID 1172814As productuspto-grants-2010_11
HRID 1172815 reaction equation
HRID 1172815As reactantuspto-grants-2010_11
HRID 1216069 reaction equation
HRID 1216069As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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