chempirical

Fibric acid

C10H12O3CAS 943-45-3180.20 g/mol

Open in Covalent MOL file
OOHO
Carboxylic acidEther

Properties

Molecular formula
C10H12O3
Molar mass
180.20 g/mol
Exact mass
180.0786 Da
Melting point
97–98 °C
logP
1.93Crippen estimate
Polar surface area
46.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
3

Identifiers

CAS number
943-45-3
SMILES
CC(C)(Oc1ccccc1)C(=O)O
InChIKey
ILPUOPPYSQEBNJ-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O3/c1-10(2,9(11)12)13-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,11,12)

Weigh it out

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

Names and synonyms

11 names
  • Propanoic acid, 2-methyl-2-phenoxy-
  • Propionic acid, 2-methyl-2-phenoxy-
  • 2-Methyl-2-phenoxypropanoic acid
  • Phenoxy-α-isobutyric acid
  • 2-Phenoxy-2-methylpropionic acid
  • Phenoxyisobutyric acid
  • 2-Phenoxyisobutyric acid
  • 2,2-Dimethylphenoxyacetic acid
  • 2,2-Dimethyl-2-phenoxyacetic acid
  • NSC 34010
  • 2-Phenoxy-2,2-dimethyl acetic acid

Work with Fibric 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

Clofibric acid882-09-770 % similar Fenofibric acid42017-89-059 % similar Ciprofibrate52214-84-356 % similar Efaproxiral131179-95-853 % similar 2,2-Diphenylpropionic acid5558-66-748 % similar 2-Methyl-2-phenylpropanoic acid826-55-148 % similar Bezafibrate41859-67-047 % similar Triphenylacetic acid595-91-544 % similar

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

Same formula

(R)-(+)-2-Benzyloxypropionic acid100836-85-9 Anisyl acetate104-21-2 3-(3-Methoxyphenyl)propionic acid10516-71-9 (-)-Ethyl mandelate10606-72-1 3-Ethoxy-4-methoxybenzaldehyde1131-52-8 3,4-Dimethoxyacetophenone1131-62-0 2′,5′-Dimethoxyacetophenone1201-38-3 4-Ethoxy-3-methoxybenzaldehyde120-25-2

Elsewhere

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