3-{4-[4-(4-Chloro-2-phenoxy-phenoxy)-phenoxy]-2-methyl-phenyl}-propionic acid

HCID 57894232
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Basic information

Standard SMILES
Cc1cc(Oc2ccc(Oc3ccc(Cl)cc3Oc3ccccc3)cc2)ccc1CCC(=O)O
InChIKey
XAFSCGPCPSBPGQ-UHFFFAOYSA-N
Molecular formula
C28H23ClO5
Average molar mass
474.9 g/mol

Names & identifiers

Preferred name
3-{4-[4-(4-Chloro-2-phenoxy-phenoxy)-phenoxy]-2-methyl-phenyl}-propionic acid
IUPAC
3-[4-[4-(4-chloro-2-phenoxyphenoxy)phenoxy]-2-methylphenyl]propanoic acid

Names & synonyms

SCHEMBL4513587XAFSCGPCPSBPGQ-UHFFFAOYSA-N3-{4-[4-(4-Chloro-2-phenoxy-phenoxy)-phenoxy]-2-methyl-phenyl}-propionic acid

Database identifiers

PubChem CID
57894232

Properties

Computed structural properties

XLogP
7.3
Topological polar surface area
65 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
34

Related reactions

1 records
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Compound notes

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