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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:
Assay:
≥99%
Form:
liquid
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vapor density

4 (vs air)

Quality Level

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

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

General description

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

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.



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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)