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756377

3-(2-Acetoxy-4,6-dimethylphenyl)-3-methylbutyric acid

Name: 3-(2-Acetoxy-4,6-dimethylphenyl)-3-methylbutyric acid
Brand: ALDRICH

97%

Synonym(s):

2-(Acetyloxy)-β,β,4,6-tetramethylbenzenepropanoic acid, 3-(2-Acetoxy-4,6-dimethylphenyl)-3-methylbutanoic acid

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About This Item

Empirical Formula (Hill Notation):

C₁₅H₂₀O₄

CAS Number:

134098-68-3

Molecular Weight:

264.32

NACRES:

NA.22

PubChem Substance ID:

329766537

UNSPSC Code:

12352108

MDL number:

MFCD03414459

Assay:

97%

Form:

solid

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Properties

Quality Segment

100

assay

97%

form

solid

mp

113-118 °C

functional group

carboxylic acid, ester

storage temp.

2-8°C

SMILES string

CC(=O)Oc1cc(C)cc(C)c1C(C)(C)CC(O)=O

InChI

1S/C15H20O4/c1-9-6-10(2)14(12(7-9)19-11(3)16)15(4,5)8-13(17)18/h6-7H,8H2,1-5H3,(H,17,18)

InChI key

IRUYOPOSEOEWIN-UHFFFAOYSA-N

Description

Application

Used as a trimethyl lock in stable chromogenic substrates for esterases

Pictograms

GHS06

Signal Word

Danger

Hazard Codes

H301,H319

Precautionary Statements

P301 + P310 + P330 - P305 + P351 + P338

Hazard Classifications

Acute Tox. 3 Oral - Eye Irrit. 2

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

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