n-Caproic acid vinyl ester (stabilized with HQ)

Product Information

Molecular Formula:
C8H14O2
Molecular Weight:
142.2
Description
Vinyl hexanoate is a natural product found in Akebia trifoliata.
Synonyms
n-Caproic acid vinyl ester (stabilized with HQ); Vinyl n-hexanoate
IUPAC Name
ethenyl hexanoate
Canonical SMILES
CCCCCC(=O)OC=C
InChI
InChI=1S/C8H14O2/c1-3-5-6-7-8(9)10-4-2/h4H,2-3,5-7H2,1H3
InChI Key
LZWYWAIOTBEZFN-UHFFFAOYSA-N
Boiling Point
168.6°C at 760mmHg
Flash Point
51 °C
Purity
stabilized
Density
0,887
Appearance
Colorless to Almost colorless clear liquid
Refractive Index
1.42

Safety Information

Hazards
H226:
Flammable liquid and vapour.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P370+P378:
In case of fire:
Use for extinction:

Computed Properties

XLogP3
2.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
6
Exact Mass
142.099379685 g/mol
Monoisotopic Mass
142.099379685 g/mol
Topological Polar Surface Area
26.3Ų
Heavy Atom Count
10
Formal Charge
0
Complexity
108
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
JP-2022040149-A Adhesive composition and laminated film using it 2021-12-21
CN-114085631-A Adhesive composition, method for producing the same, and article using the same 2021-12-02
CN-114057709-A Puerarin acid ester derivative and preparation method and application thereof 2021-10-28
CN-113820423-A Method and device for extracting and detecting volatile components at different parts of snakehead 2021-09-26
CN-114149530-A Alkali-soluble polymer for preparing LDI dry film and preparation method thereof 2021-09-23
CN-113604520-A Method for preparing gastrodin triester by enzymatic catalysis 2021-07-27
CN-113943668-A Lactobacillus plantarum with high environmental stress resistance and fatty aldehyde resistance and application thereof 2021-07-16
KR-102364956-B1 Prefabricated panels for thermal insulation 2021-07-15
JP-2022013755-A Tile construction method and adhesive composition 2021-06-17
KR-102315537-B1 Porous polymer thin film-sulfur nanoparticles-graphene composite, preparing method of the same, and lithium-sulfur battery including the same 2021-04-07

Literatures

PMID Publication Date Title Journal
22434352 2012-04-01 Sugar ester synthesis by thermostable lipase from Streptomyces thermocarboxydus ME168 Applied biochemistry and biotechnology
18512020 2008-10-01 Resolution of secondary alcohols via Carica papaya lipase-catalyzed enantioselective acylation Biotechnology letters
16471924 2006-02-01 Nanoparticles of beta-cyclodextrin esters obtained by self-assembling of biotransesterified beta-cyclodextrins Biomacromolecules
16219374 2006-01-15 Alterations in aortic vascular reactivity to angiotensin 1-7 in 17-beta-estradiol-treated female SD rats Regulatory peptides
12889833 2003-06-01 Regioselective synthesis of kojic acid esters by Bacillus subtilis protease Biotechnology letters
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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