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Merck
CN

W317215

Hexyl isobutyrate

natural (US), ≥97%, FG

Synonym(s):

Hexyl-2-methylpropionate

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About This Item

Linear Formula:
(CH3)2CHCO2(CH2)5CH3
CAS Number:
2349-07-7
Molecular Weight:
172.26
FEMA Number:
3172
Council of Europe no.:
646
UNSPSC Code:
12164502
PubChem Substance ID:
329830573
EC Number:
219-075-8
Flavis number:
9.478
MDL number:
MFCD00027297
Organoleptic:
apple; green; fruity; pear; sweet
Grade:
FG, Halal, Kosher, natural (US)
Food allergen:
no known allergens

Key Documents

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SMILES string

CCCCCCOC(=O)C(C)C

InChI key

CYHBDKTZDLSRMY-UHFFFAOYSA-N

InChI

1S/C10H20O2/c1-4-5-6-7-8-12-10(11)9(2)3/h9H,4-8H2,1-3H3

grade

FG, Halal, Kosher, natural (US)

reg. compliance

EU Regulation 1334/2008 & 178/2002

assay

≥97%

refractive index

n20/D 1.413 (lit.)

density

0.86 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

organoleptic

apple; green; fruity; pear; sweet

Storage Class

10 - Combustible liquids

wgk

WGK 2

flash_point_f

163.4 °F - closed cup

flash_point_c

73 °C - closed cup

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKCC0426
MKBJ5504

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Zhilin Zhang et al.
Journal of insect science (Online), 14 (2014-12-21)
The morphological structure of the metathoracic scent glands (MTGs) in Adelphocoris suturalis was observed by utilizing scanning electron microscope (SEM). Also, the secretions of MTGs in male and female were analyzed by using gas chromatography-mass spectrometry (GC-MS). The result showed

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