ChemicalBook--->CAS DataBase List--->13836-62-9

13836-62-9

13836-62-9 Structure

13836-62-9 Structure
IdentificationBack Directory
[Name]

2-methoxy-2-methylpropanoic acid
[CAS]

13836-62-9
[Synonyms]

2-methoxy-2-methylpropanoic acid
2-Methoxy-2-Methylpropionic Acid
2-Methyl-2 -Methoxypropanoic acid
propanoic acid, 2-methoxy-2-methyl-
2-methoxy-2-methylpropanoic acid(SALTDATA: FREE)
[Molecular Formula]

C5H10O3
[MDL Number]

MFCD07787581
[MOL File]

13836-62-9.mol
[Molecular Weight]

118.13
Chemical PropertiesBack Directory
[Boiling point ]

205℃
[density ]

1.053
[Fp ]

85℃
[storage temp. ]

2-8°C
[form ]

liquid
[pka]

3.74±0.10(Predicted)
[color ]

Brown
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
[HazardClass ]

IRRITANT
[HS Code ]

2918999090
Spectrum DetailBack Directory
[Spectrum Detail]

2-methoxy-2-methylpropanoic acid(13836-62-9)1HNMR
Hazard InformationBack Directory
[Synthesis]

Propanoic acid, 2-methoxy-2-methyl-, methyl ester

17860-39-8

2-methoxy-2-methylpropanoic acid

13836-62-9

General procedure for the synthesis of 2-methoxy-2-methylpropionic acid from methyl 2-methoxy-2-methylpropionate: Methyl 2-methoxy-2-methylpropionate (2.08 g, 15.74 mmol) was dissolved in methanol (20 mL), and aqueous (10 mL) solution of potassium hydroxide (1.766 g, 31.5 mmol) was added, and the reaction was stirred for 4 h at room temperature. Upon completion of the reaction, the organic solvent was removed by distillation under reduced pressure and the remaining aqueous phase was washed with a 1:1 hexahydronaphthalene/ether mixture and subsequently acidified with 3N hydrochloric acid. The acidified aqueous phase was extracted with dichloromethane (3×20 mL), and the organic phases were combined and dried with anhydrous sodium sulfate. The dried organic phase was concentrated to dryness under reduced pressure to afford 2-methoxy-2-methylpropionic acid (1.24 g, 67% yield). The product was characterized by 1H NMR (400 MHz, DMSO-d6): δ 12.48 (s, 1H), 3.12 (s, 3H), 1.27 (s, 6H).

[References]

[1] Patent: US2018/282328, 2018, A1. Location in patent: Paragraph 0843; 0844
[2] Patent: US2014/275016, 2014, A1. Location in patent: Paragraph 0245
[3] Patent: US2014/275080, 2014, A1. Location in patent: Paragraph 0376
[4] Chemical & Pharmaceutical Bulletin, 1983, vol. 31, # 5, p. 1505 - 1517
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