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W239402

α,α-Dimethylphenethyl butyrate

≥95%, FCC, FG

Synonym(s):

(1-cyclohexyl-2-methylpropan-2-yl) butanoate, Benzyl dimethyl carbinol butyrate, Benzyl dimethyl carbinyl butyrate, Dimethyl benzyl carbinyl butyrate, dmbc butyrate

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About This Item

Linear Formula:
CH3CH2CH2CO2C(CH3)2CH2C6H5
CAS Number:
10094-34-5
Molecular Weight:
220.31
FEMA Number:
2394
Council of Europe no.:
2084
UNSPSC Code:
12164502
PubChem Substance ID:
24901043
Flavis number:
9.232
EC Number:
233-221-8
NACRES:
NA.21
MDL number:
MFCD00027132
Organoleptic:
green; fruity; floral; herbaceous
Grade:
FG, Halal, Kosher
Biological source:
synthetic
Agency:
meets requirements for JECFA
Food allergen:
no known allergens
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biological source

synthetic

Quality Segment

300, 400

grade

FG, Halal, Kosher

agency

meets requirements for JECFA

reg. compliance

EU Regulation 1334/2008 & 178/2002, FCC, FDA 21 CFR 117, FDA 21 CFR 172.515

assay

≥95%

refractive index

n20/D 1.4839 (lit.)

bp

237-255 °C (lit.)

density

0.969 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

green; fruity; floral; herbaceous

SMILES string

CCCC(=O)OC(C)(C)Cc1ccccc1

InChI

1S/C14H20O2/c1-4-8-13(15)16-14(2,3)11-12-9-6-5-7-10-12/h5-7,9-10H,4,8,11H2,1-3H3

InChI key

SHSGYHAHMQLYRB-UHFFFAOYSA-N

General description

α,α-Dimethylphenethyl butyrate belongs to the fragrance structural group aryl alkyl alcohol simple acid esters (AAASAE). The compound has a mild, herbaceous odor. It is a fragrance ingredient used in various non-cosmetic products, such as detergents, household cleansers, and shampoos. It is also found in decorative cosmetics, toiletries, and shampoos.

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H315,H412

Hazard Classifications

Aquatic Chronic 3 - Skin Irrit. 2

Storage Class

10 - Combustible liquids

wgk

WGK 2

flash_point_f

242.6 °F - closed cup

flash_point_c

117 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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