2-(4-Fluorophenoxy)-4-tert-butylbenzoic acid

HCID 58988089
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Basic information

Standard SMILES
CC(C)(C)c1ccc(C(=O)O)c(Oc2ccc(F)cc2)c1
InChIKey
RXZOXCJPDJNYPR-UHFFFAOYSA-N
Molecular formula
C17H17FO3
Average molar mass
288.31 g/mol

Names & identifiers

Preferred name
2-(4-Fluorophenoxy)-4-tert-butylbenzoic acid
IUPAC
4-tert-butyl-2-(4-fluorophenoxy)benzoic acid

Names & synonyms

SCHEMBL4766809RXZOXCJPDJNYPR-UHFFFAOYSA-N2-(4-fluorophenoxy)-4-tert-butylbenzoic acid

Database identifiers

PubChem CID
58988089

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
46.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
21

Related reactions

2 records
New reaction record

Linked notes

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