chempirical

(4-Hydroxyphenoxy)acetic acid

C8H8O4CAS 1878-84-8168.15 g/mol

Open in Covalent MOL file
OHOOOH
Carboxylic acidEtherPhenol

Properties

Molecular formula
C8H8O4
Molar mass
168.15 g/mol
Exact mass
168.0423 Da
Melting point
155–156 °C
logP
0.86Crippen estimate
Polar surface area
66.8 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
3

Identifiers

CAS number
1878-84-8
SMILES
O=C(O)COc1ccc(O)cc1
InChIKey
PKGWLCZTTHWKIZ-UHFFFAOYSA-N
InChI
InChI=1S/C8H8O4/c9-6-1-3-7(4-2-6)12-5-8(10)11/h1-4,9H,5H2,(H,10,11)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • Acetic acid, 2-(4-hydroxyphenoxy)-
  • Acetic acid, (p-hydroxyphenoxy)-
  • Acetic acid, (4-hydroxyphenoxy)-
  • 2-(4-Hydroxyphenoxy)acetic acid
  • p-Hydroxyphenoxyacetic acid
  • O-(4-Hydroxyphenyl)glycolic acid

Work with (4-Hydroxyphenoxy)acetic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2′-[1,4-Phenylenebis(oxy)]bis[acetic acid]2245-53-681 % similar 2-(4-Bromophenoxy)acetic acid1878-91-771 % similar Phenoxyacetic acid122-59-867 % similar 4-Chlorophenoxyacetic acid122-88-366 % similar 4-Methoxyphenoxyacetic acid1877-75-466 % similar 4-Iodophenoxyacetic acid1878-94-066 % similar 4-Fluorophenoxyacetic acid405-79-866 % similar (4-Methylphenoxy)acetic acid940-64-766 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3,4-Dihydroxyphenylacetic acid102-32-9 5-(Acetoxymethyl)-2-furaldehyde10551-58-3 4-Hydroxymandelic acid1198-84-1 Vanillic acid121-34-6 Methyl 3,4-dihydroxybenzoate2150-43-8 3,5-Dihydroxybenzoic acid methyl ester2150-44-9 Methyl 2,6-dihydroxybenzoate2150-45-0 Methyl 2,5-dihydroxybenzoate2150-46-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook