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4-tert-Butyl-2,6-dimethyl-alpha-toluic acid

CAS No.
854646-92-7
Chemical Name:
4-tert-Butyl-2,6-dimethyl-alpha-toluic acid
Synonyms
Xylometazoline EP Impurity F;Xylometazoline hydrochloride impurity C;Xylometazoline Hydrochloride EP Impurity F;2,6-Dimethyl-4-tert-butylphenylacetic Acid;4-tert-Butyl-2,6-dimethyl-alpha-toluic acid;[4-(1,1-Dimethylethyl)-2,6-dimethylphenyl]acetic Acid;Benzeneacetic acid, 4-(1,1-dimethylethyl)-2,6-dimethyl-;Xylometazoline Impurity 6(Xylometazoline EP Impurity F)
CBNumber:
CB52717318
Molecular Formula:
C14H20O2
Molecular Weight:
220.31
MDL Number:
MFCD21886590
MOL File:
854646-92-7.mol
Last updated:2023-07-09 08:28:05

4-tert-Butyl-2,6-dimethyl-alpha-toluic acid Properties

Melting point 168℃
Boiling point 331.4±11.0 °C(Predicted)
Density 1.019±0.06 g/cm3(Predicted)
solubility DMSO (Slightly), Methanol (Slightly)
pka 4.42±0.10(Predicted)
form Solid
color Off-White to Brown
FDA UNII MPG4RR6S2D

SAFETY

Risk and Safety Statements

Symbol(GHS)  GHS hazard pictograms
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264-P270-P301+P312-P330-P501

4-tert-Butyl-2,6-dimethyl-alpha-toluic acid price

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
TRC D479020 2,​6-​Dimethyl-​4-​tert-​butylphenylaceticAcid 854646-92-7 10mg $70 2021-12-16 Buy
Product number Packaging Price Buy
D479020 10mg $70 Buy

4-tert-Butyl-2,6-dimethyl-alpha-toluic acid Chemical Properties,Uses,Production

Uses

4-tert-Butyl-2,6-dimethyl-alpha-toluic acid is an impurity of Xylometazoline (X749950), a vasoconstrictor involved in signal transduction, also used as a nasal decongestant. May be used in treatments involving ischemic injury due to the ability to shift energy metabolism from mitochondrial to glycolysis (2).

98-19-1
64-19-7
298-12-4
854646-92-7
Synthesis of 4-tert-Butyl-2,6-dimethyl-alpha-toluic acid from 1-tert-Butyl-3,5-dimethylbenzene and Acetic acid and Glyoxylic acid

4-tert-Butyl-2,6-dimethyl-alpha-toluic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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4-tert-Butyl-2,6-dimethyl-alpha-toluic acid [4-(1,1-Dimethylethyl)-2,6-dimethylphenyl]acetic Acid Xylometazoline hydrochloride impurity C Xylometazoline EP Impurity F 2,6-Dimethyl-4-tert-butylphenylacetic Acid Xylometazoline Impurity 6(Xylometazoline EP Impurity F) Benzeneacetic acid, 4-(1,1-dimethylethyl)-2,6-dimethyl- Xylometazoline Hydrochloride EP Impurity F 854646-92-7