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227455

Methyl 2,2-dimethyl-3-hydroxypropionate

Name: Methyl 2,2-dimethyl-3-hydroxypropionate
Brand: ALDRICH

98%

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About This Item

Linear Formula:

HOCH₂C(CH₃)₂CO₂CH₃

CAS Number:

14002-80-3

Molecular Weight:

132.16

UNSPSC Code:

12352100

PubChem Substance ID:

24853633

EC Number:

237-805-3

MDL number:

MFCD00009707

Assay:

98%

Form:

liquid

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Properties

assay

98%

form

liquid

refractive index

n20/D 1.428 (lit.)

bp

177-178 °C/740 mmHg (lit.)

density

1.036 g/mL at 25 °C (lit.)

functional group

ester, hydroxyl

SMILES string

COC(=O)C(C)(C)CO

InChI

1S/C6H12O3/c1-6(2,4-7)5(8)9-3/h7H,4H2,1-3H3

InChI key

KJRFTNVYOAGTHK-UHFFFAOYSA-N

Description

General description

Kinetics of decomposition of methyl 2,2-dimethyl-3-hydroxypropionate to methyl isobutyrate and formaldehyde in a static system has been investigated.

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

168.8 °F - closed cup

flash_point_c

76 °C - closed cup

Regulatory Information

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Joint experimental and theoretical studies of the mechanism for the gas phase elimination kinetics of methyl 2,2-dimethyl-3-hydroxypropionate.

Alexandra Rotinov et al.

The journal of physical chemistry. A, 113(15), 3491-3497 (2009-03-25)

Methyl 2,2-dimethyl-3-hydroxypropionate was found to decompose, in a static system, mainly to methyl isobutyrate and formaldehyde. The reaction rates were affected in packed and unpacked clean Pyrex vessels, demonstrating little but significant surface effect. However, in vessels seasoned with allyl

Global Trade Item Number

SKU	GTIN
227455-25G	04061836683191