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W255009

Heptyl isobutyrate

≥98%

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About This Item

Linear Formula:
(CH3)2CHCO2(CH2)6CH3
CAS Number:
2349-13-5
Molecular Weight:
186.29
FEMA Number:
2550
Council of Europe no.:
295
UNSPSC Code:
12164502
PubChem Substance ID:
24901138
EC Number:
219-076-3
Flavis number:
9.420
MDL number:
MFCD00129704
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biological source

synthetic

reg. compliance

FDA 21 CFR 172.515

assay

≥98%

refractive index

n20/D 1.418 (lit.)

bp

212 °C (lit.)

density

0.863 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

organoleptic

apricot; cherry; grape; green; oily; orange; herbaceous; woody; peach; pear; pineapple; plum; raspberry; wine-like

SMILES string

CCCCCCCOC(=O)C(C)C

InChI

1S/C11H22O2/c1-4-5-6-7-8-9-13-11(12)10(2)3/h10H,4-9H2,1-3H3

InChI key

RFDUMBPGZUIKOG-UHFFFAOYSA-N

Biochem/physiol Actions

Odor at 1%
Taste at 5-20 ppm

Other Notes

Natural occurrence: Hop Oil.
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pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

140.0 °F - closed cup

flash_point_c

60 °C - closed cup

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
19604CR

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Mosciano, G.
Perfumer & Flavorist, 26, 80-80 (2001)