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21530

Sigma-Aldrich

Hexanoic acid

purum, ≥98.0% (GC)

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Synonym(s):
Acid C6, Caproic acid
Linear Formula:
CH3(CH2)4COOH
CAS Number:
Molecular Weight:
116.16
Beilstein/REAXYS Number:
773837
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

vapor density

4 (vs air)

Quality Level

vapor pressure

0.18 mmHg ( 20 °C)

grade

purum

assay

≥98.0% (GC)

refractive index

n20/D 1.416
n20/D 1.4161 (lit.)

bp

202-203 °C (lit.)
203-205 °C

mp

−4 °C (lit.)

solubility

water: slightly soluble 1.082g/100g(lit.)
diethyl ether: soluble(lit.)
ethanol: soluble(lit.)

density

0.927 g/mL at 25 °C (lit.)

organoleptic

pungent

SMILES string

CCCCCC(O)=O

InChI

1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)

InChI key

FUZZWVXGSFPDMH-UHFFFAOYSA-N

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pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1C

wgk_germany

WGK 1

flash_point_f

215.6 °F

flash_point_c

102 °C

ppe

Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter


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Acyl migration in 1, 2-dibutyrin dependence on solvent and water activity.
Sjursnes BJ and Anthonsen T.
Biocatalysis and Biotransformation, 9(1-4), 285-297 (1994)
A study on the stability of MCM-41-supported heteropoly acids under liquid-and gas-phase esterification conditions.
Verhoef MJ, et al.
Microporous and Mesoporous Materials : The Official Journal of the International Zeolite Association, 27(2), 365-371 (1999)
Formation of ultrathin polypyrrole (PPY) films on alumina particles using adsorbed hexanoic acid as a template.
Cho G, et al.
Langmuir, 16(10), 4424-4429 (2000)
Pierre Daumar et al.
Bioconjugate chemistry, 23(8), 1557-1566 (2012-07-13)
Solid tumors often develop an acidic microenvironment, which plays a critical role in tumor progression and is associated with increased level of invasion and metastasis. The 37-residue pH (low) insertion peptide (pHLIP) is under study as an imaging platform because
Przemysław Drzewicz et al.
Environmental science & technology, 46(16), 8984-8991 (2012-07-18)
Large volumes of oil sands process-affected water (OSPW) are produced during the extraction of bitumen from oil sands in Alberta, Canada. The degradation of a model naphthenic acid, cyclohexanoic acid (CHA), and real naphthenic acids (NAs) from OSPW were investigated

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