3-Vinylbenzoic Acid

Inquiry

Molecular Formula:

C9H8O2

Molecular Weight:

148.16

CAS Number:

28447-20-3

Catalog Number:

28447-20-3

Product Information

Molecular Formula:

C9H8O2

Molecular Weight:

148.16

Description

3-Vinylbenzoic Acid is widely used in drug synthesis for cancer and inflammatory diseases.

Synonyms

3-VINYLBENZOIC ACID; RARECHEM AL BO 0913; Benzoic acid, 3-ethenyl- (9CI); Benzoic acid, 3-ethenyl-

IUPAC Name

3-ethenylbenzoic acid

Canonical SMILES

C=CC1=CC(=CC=C1)C(=O)O

InChI

InChI=1S/C9H8O2/c1-2-7-4-3-5-8(6-7)9(10)11/h2-6H,1H2,(H,10,11)

InChI Key

VWXZFDWVWMQRQR-UHFFFAOYSA-N

Melting Point

91-95 ℃ (lit.)

Flash Point

Not applicable

Purity

0.96

Safety Information

Hazards

H315 - H319 - H335

Precautionary Statement

P302 + P352 - P305 + P351 + P338

Computed Properties

XLogP3

2.8

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

148.052429494 g/mol

Monoisotopic Mass

148.052429494 g/mol

Topological Polar Surface Area

37.3Å²

Heavy Atom Count

Formal Charge

Complexity

163

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
CN-113004569-A	Method for modifying porous membrane, modified porous membrane and application thereof	2021-02-09
CN-112390921-A	Synthetic viscosity-reducing polycarboxylate superplasticizer and preparation method thereof	2020-11-05
WO-2022045308-A1	Compound, method for producing compound, adhesive composition and adhesive tape	2020-08-28
WO-2022039224-A1	Coloured resin composition, colour filter, and image display device	2020-08-20
WO-2022030440-A1	Vinyl polymers and production method therefor	2020-08-07
JP-2022030091-A	Manufacturing method of semiconductor device, and expanded tape and its manufacturing method	2020-08-06
JP-2022030093-A	Manufacturing method of semiconductor devices and expanded tape	2020-08-06
JP-2022029701-A	Compounds and coloring compositions	2020-08-05
JP-2022029725-A	Adhesive sheet and adhesive composition	2020-08-05
JP-2022029023-A	Creation of functional composite fine particles using a gradient type polymer surfactant and a liquid drying method in combination	2020-08-04

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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