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Merck
CN

W280220

2-Octanone

natural, 98%, FG

Synonym(s):

Hexyl methyl ketone

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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
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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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pictograms

FlameExclamation mark

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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