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W254820

Sigma-Aldrich

Heptyl alcohol

natural, 98%

Synonym(s):

1-Heptanol, Heptyl alcohol

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About This Item

Linear Formula:
CH3(CH2)6OH
CAS Number:
111-70-6
Molecular Weight:
116.20
FEMA Number:
2548
Beilstein:
1731686
EC Number:
203-897-9
MDL number:
MFCD00002986
UNSPSC Code:
12164502
PubChem Substance ID:
329830438
Flavis number:
2.021
NACRES:
NA.21

grade

Halal
Kosher
natural

reg. compliance

FDA 21 CFR 117

vapor pressure

0.5 mmHg ( 20 °C)

Assay

98%

autoignition temp.

662 °F

refractive index

n20/D 1.424 (lit.)

bp

176 °C (lit.)

mp

−36 °C (lit.)

density

0.822 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

green; leafy; waxy; vegetable; fruity

SMILES string

CCCCCCCO

InChI

1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3

InChI key

BBMCTIGTTCKYKF-UHFFFAOYSA-N

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Other Notes

Natural occurrence: Apple, apricot, beer, butter, macadamia nut, mushroom, strawberry, tea, tobacco, and wine.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H319,H412

Hazard Classifications

Aquatic Chronic 3 - Eye Irrit. 2

Storage Class Code

10 - Combustible liquids

WGK

WGK 1

Flash Point(F)

158.0 °F

Flash Point(C)

70 °C

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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There are numerous published reports about dispersive liquid phase microextraction of the wide range of substances, however, till now no broadly accepted systematic and purpose oriented selection of extraction solvent has been proposed. Most works deal with the optimization of
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