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About This Item
Linear Formula:
CH3CH2CH(CH3)COOCH3
CAS Number:
Molecular Weight:
116.16
FEMA Number:
2719
Council of Europe no.:
2085
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.483
EC Number:
212-778-0
NACRES:
NA.21
MDL number:
Beilstein/REAXYS Number:
1720409
Organoleptic:
fruity; ethereal
Grade:
FG, Kosher
Biological source:
synthetic
Agency:
meets purity specifications of JECFA
Food allergen:
no known allergens
biological source
synthetic
grade
FG, Kosher
agency
meets purity specifications of JECFA
reg. compliance
EU Regulation 1334/2008 & 178/2002, FCC, FDA 21 CFR 172.515
assay
≥98%
refractive index
n20/D 1.393 (lit.)
bp
115 °C (lit.)
density
0.88 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
organoleptic
fruity; ethereal
SMILES string
CCC(C)C(=O)OC
InChI
1S/C6H12O2/c1-4-5(2)6(7)8-3/h5H,4H2,1-3H3
InChI key
OCWLYWIFNDCWRZ-UHFFFAOYSA-N
General description
Methyl 2-methylbutyrate is an important odor-active constituent of pineapple, apple, cantaloupe, cucumber and strawberries.
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signalword
Warning
hcodes
Hazard Classifications
Flam. Liq. 3
Storage Class
3 - Flammable liquids
flash_point_f
89.6 °F - closed cup
flash_point_c
32 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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