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线性分子式:
CH3CH2CH2CO2C(CH3)2CH2C6H5
化学文摘社编号:
分子量:
220.31
FEMA Number:
2394
Council of Europe no.:
2084
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.232
EC Number:
233-221-8
NACRES:
NA.21
MDL number:
Organoleptic:
green; fruity; floral; herbaceous
Grade:
FG, Halal, Kosher
Biological source:
synthetic
Agency:
meets requirements for JECFA
Food allergen:
no known allergens
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
biological source
synthetic
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
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.
signalword
Warning
hcodes
Hazard Classifications
Aquatic Chronic 3 - Skin Irrit. 2
存储类别
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
Fragrance material review on 1, 1-dimethyl-2-phenylethyl butyrate
McGinty D, et al.
Food And Chemical Toxicology, 50, S439-S442 (2012)
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