W336900
Isobutyl isovalerate
natural (US), ≥99%, FG
Synonym(s):
2-Methylpropyl 3-methylbutyrate, Isobutyl 3-methyl butyrate
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About This Item
Empirical Formula (Hill Notation):
C9H18O2
CAS Number:
Molecular Weight:
158.24
FEMA Number:
3369
Council of Europe no.:
568
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
9.472
EC Number:
209-653-8
NACRES:
NA.21
MDL number:
Organoleptic:
apple; green; fruity; sweet
Grade:
FG, Fragrance grade, Halal, Kosher, natural (US)
Agency:
follows IFRA guidelines
Food allergen:
no known allergens
Quality Level
grade
FG, Fragrance grade, Halal, Kosher, natural (US)
agency
follows IFRA guidelines
reg. compliance
EU Regulation 1223/2009, EU Regulation 1334/2008 & 872/2012
assay
≥99%
refractive index
n20/D 1.4060
density
0.851 g/mL at 25 °C
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
fragrance allergen
no known allergens
organoleptic
apple; green; fruity; sweet
SMILES string
CC(C)COC(=O)CC(C)C
InChI
1S/C9H18O2/c1-7(2)5-9(10)11-6-8(3)4/h7-8H,5-6H2,1-4H3
InChI key
KEBDNKNVCHQIJU-UHFFFAOYSA-N
signalword
Warning
hcodes
pcodes
Hazard Classifications
Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 2
flash_point_f
127.4 °F - closed cup
flash_point_c
53.00 °C - closed cup
Regulatory Information
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