vinyl crotonate

Inquiry

Molecular Formula:

C6H8O2

Molecular Weight:

112.13

CAS Number:

14861-06-4

Catalog Number:

14861-06-4

Product Information

Molecular Formula:

C6H8O2

Molecular Weight:

112.13

Description

Vinyl Crotonate is a widely utilized chemical compound in the biomedical industry and assumes a fundamental role in synthesizing pharmaceutical drugs that combat a plethora of diseases. The diverse range of ailments this compound tackles encompasses inflammation, cancer, and cardiovascular disorders. Through its multifaceted properties and widespread applications, vinyl crotonate emerges as a critical catalyst in propelling the advancement of groundbreaking biomedical therapies.

Synonyms

CROTONIC ACID VINYL ESTER; BUT-2-ENOIC ACID VINYL ESTER; VINYL CROTONATE; Vinyl 2-butenoate; 2-Butenoic acid, ethenyl ester; 2-butenoicacid,ethenylester

IUPAC Name

ethenyl (E)-but-2-enoate

Canonical SMILES

CC=CC(=O)OC=C

InChI

InChI=1S/C6H8O2/c1-3-5-6(7)8-4-2/h3-5H,2H2,1H3/b5-3+

InChI Key

IYNRVIKPUTZSOR-HWKANZROSA-N

Boiling Point

133-134ºC

Melting Point

-60 ℃

Flash Point

32 ℃

Purity

95%

Density

0.94

Appearance

CLEAR COLOURLESS TO YELLOW LIQUID

Storage

0-6ºC

Refractive Index

1.45

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

1.4

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

112.052429494 g/mol

Monoisotopic Mass

112.052429494 g/mol

Topological Polar Surface Area

26.3Å²

Heavy Atom Count

Formal Charge

Complexity

114

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
JP-2022009148-A	Laminated tube	2021-10-14
JP-7005078-B1	Adhesive resin composition	2021-10-08
JP-6998490-B1	Ink composition for photocurable inkjet printing	2021-08-30
JP-7004104-B1	Binder dispersion for non-water secondary battery separator, slurry composition, non-water secondary battery separator, and non-water secondary battery	2021-05-31
US-10975181-B1	Ethylene-vinyl alcohol copolymer and producing method thereof	2020-12-30
JP-6923064-B1	Laminates and wavelength cut filters	2020-12-15
JP-6879425-B1	Laminated body, thermal recording body, and image forming method	2020-11-17
WO-2022051168-A1	Coating composition with improved block and humidity resistance, direct to metal adherence and low voc content	2020-09-03
JP-2022040767-A	Reinforcing fiber and its manufacturing method, and a molded product using it	2020-08-31
JP-2022040774-A	Molded body and its manufacturing method	2020-08-31

The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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