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About This Item
Linear Formula:
CH3(CH2)5COCH3
CAS Number:
Molecular Weight:
128.21
Flavis number:
7.019
PubChem Substance ID:
UNSPSC Code:
12164502
FEMA Number:
2802
NACRES:
NA.21
EC Number:
203-837-1
MDL number:
Beilstein/REAXYS Number:
635843
Organoleptic:
woody; earthy
Grade:
FG, Fragrance grade, Halal, Kosher, natural
Agency:
follows IFRA guidelines
Food allergen:
no known allergens
Quality Segment
grade
FG, Fragrance grade, Halal, Kosher, natural
agency
follows IFRA guidelines
reg. compliance
EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002, FDA 21 CFR 172.515
assay
98%
refractive index
n20/D 1.416 (lit.)
bp
173 °C (lit.)
mp
−16 °C (lit.)
density
0.819 g/mL at 25 °C (lit.)
application(s)
flavors and fragrances
documentation
see Safety & Documentation for available documents
food allergen
no known allergens
fragrance allergen
no known allergens
organoleptic
woody; earthy
SMILES string
CCCCCCC(C)=O
InChI
1S/C8H16O/c1-3-4-5-6-7-8(2)9/h3-7H2,1-2H3
InChI key
ZPVFWPFBNIEHGJ-UHFFFAOYSA-N
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signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Dermal - Flam. Liq. 3
Storage Class
3 - Flammable liquids
wgk
WGK 1
flash_point_f
132.8 °F - closed cup
flash_point_c
56 °C - closed cup
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