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Merck

153745

Hexanoic acid

≥99%

Synonym(s):

Acid C6, Caproic acid

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About This Item

Linear Formula:
CH3(CH2)4COOH
CAS Number:
Molecular Weight:
116.16
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
205-550-7
Beilstein/REAXYS Number:
773837
MDL number:
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Product Name

Hexanoic acid, ≥99%

InChI key

FUZZWVXGSFPDMH-UHFFFAOYSA-N

InChI

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

SMILES string

CCCCCC(O)=O

vapor density

4 (vs air)

vapor pressure

0.18 mmHg ( 20 °C)

assay

≥99%

form

liquid

refractive index

n20/D 1.4161 (lit.)

bp

202-203 °C (lit.)

mp

−4 °C (lit.)

solubility

H2O: slightly soluble
diethyl ether: easily soluble
ethanol: easily soluble

density

0.927 g/mL at 25 °C (lit.)

functional group

carboxylic acid

organoleptic

pungent

Quality Level

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Application

Hexanoic acid can be used:
  • To prepare polyethylene glycol derived nanomicelles as a non-viral gene carrier.
  • As a starting material to synthesize an amino acid L-norleucine.
  • As a reactant to prepare 4-methoxy phenyl hexyl ketone through Friedel−Crafts acylation of anisole using Hβ zeolite-based catalyst.
  • As a template in the preparation of highly conducting thin polypyrrole coated alumina composite particles.

General description

Hexanoic acid is a resistance priming inducer that protects tomato plants from Botrytis cinerea.

pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1C

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 1

flash_point_f

215.6 °F - closed cup

flash_point_c

102 °C - closed cup

ppe

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


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Enantioselective biocatalytic formal α-amination of hexanoic acid to l-norleucine
Dennig A, et al.
Organic & Biomolecular Chemistry, 16(43), 8030-8033 (2018)
Buddhadev Layek et al.
Molecular pharmaceutics, 11(3), 982-994 (2014-02-07)
Gene therapy holds immense potential as a future therapeutic strategy for the treatment of numerous genetic diseases which are incurable to date. Nevertheless, safe and efficient gene delivery remains the most challenging aspects of gene therapy. To overcome this difficulty
Friedel-Crafts acylation of anisole with hexanoic acid catalyzed by Hβ zeolite-supported tungstophosphoric acid
Bai G, et al.
Research on Chemical Intermediates, 41(8), 5041-5048 (2015)
Hexanoic acid and polyethylene glycol double grafted amphiphilic chitosan for enhanced gene delivery: influence of hydrophobic and hydrophilic substitution degree
Layek B, et al.
Molecular Pharmaceutics, 11(3), 982-994 (2014)
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)

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