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HomeProduct name list4-Methylphenylacetic acid

4-Methylphenylacetic acid

Synonym(s):4-Methylphenylacetic acid

  • CAS NO.:622-47-9
  • Empirical Formula: C9H10O2
  • Molecular Weight: 150.17
  • MDL number: MFCD00004353
  • EINECS: 210-738-7
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-11-01 18:09:03
4-Methylphenylacetic acid Structural

What is 4-Methylphenylacetic acid?

Chemical properties

white fine crystalline powder

The Uses of 4-Methylphenylacetic acid

p-Tolylacetic acid is a reagent used in the preparation of quaternary amines and epithelial sodium channel inhibition in bronchial epithelium.

Synthesis Reference(s)

The Journal of Organic Chemistry, 48, p. 1919, 1983 DOI: 10.1021/jo00159a031
Tetrahedron Letters, 28, p. 2633, 1987 DOI: 10.1016/S0040-4039(00)96167-7

Purification Methods

Crystallise the acid from heptane or water. [Beilstein 9 IV 1795.]

Properties of 4-Methylphenylacetic acid

Melting point: 88-92 °C (lit.)
Boiling point: 265-267 °C (lit.)
Density  1.0858 (rough estimate)
refractive index  1.5002 (estimate)
Flash point: 265-267°C
storage temp.  Sealed in dry,Room Temperature
solubility  soluble in Methanol
pka pK1:4.370 (25°C)
form  Fine Crystalline Powder
color  White
BRN  2043528
InChI InChI=1S/C9H10O2/c1-7-2-4-8(5-3-7)6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
CAS DataBase Reference 622-47-9(CAS DataBase Reference)
NIST Chemistry Reference p-Tolylacetic acid(622-47-9)

Safety information for 4-Methylphenylacetic acid

Signal word Warning
Pictogram(s)
ghs
Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P304+P340:IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
P405:Store locked up.

Computed Descriptors for 4-Methylphenylacetic acid

InChIKey GXXXUZIRGXYDFP-UHFFFAOYSA-N
SMILES C1(CC(O)=O)=CC=C(C)C=C1

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