3-Allyloxypropionic acid

Inquiry

Molecular Formula:

C6H10O3

Molecular Weight:

130.14

CAS Number:

22577-15-7

Catalog Number:

22577-15-7

Product Information

Molecular Formula:

C6H10O3

Molecular Weight:

130.14

Description

3-Allyloxypropionic acid is a remarkable biomedicine compound that has become an influential agent in combating inflammation-linked ailments. With its multitude of applications as a precursor in chemical synthesis, this compound unveils tantalizing possibilities in the field of medicine. Currently, studies have explored its anti-inflammatory properties, particularly for potential therapeutic benefits in areas such as rheumatoid arthritis, Crohn's disease and inflammatory bowel disease.

Synonyms

3-(Allyloxy)propanoic acid; 3-prop-2-enoxypropanoic acid; 3-(prop-2-en-1-yloxy)propanoic acid; 3-AllyloxypropionicAcid; .beta.-Allyloxypropionic acid; 3-(Allyloxy)propanoicacid; 3-(allyloxy)propionic acid; 3-(Allyloxy)propanoic acid #; 3-Allyloxypropionic Acid, 95%; 3-(Allyloxy)propanoic acid

IUPAC Name

3-prop-2-enoxypropanoic acid

Canonical SMILES

C=CCOCCC(=O)O

InChI

InChI=1S/C6H10O3/c1-2-4-9-5-3-6(7)8/h2H,1,3-5H2,(H,7,8)

InChI Key

LBJZZFXUVYHXPH-UHFFFAOYSA-N

Boiling Point

192 °C

Flash Point

92 °C

Purity

>95.0%(GC)

Density

1.06

Appearance

Colorless to Almost colorless clear liquid

Storage

0-10°C

Refractive Index

1.44

Safety Information

Hazards

H315:
Causes skin irritation.
H319:
Causes serious eye irritation.

Precautionary Statement

P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].

Computed Properties

XLogP3

0.2

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

130.062994177 g/mol

Monoisotopic Mass

130.062994177 g/mol

Topological Polar Surface Area

46.5Å²

Heavy Atom Count

Formal Charge

Complexity

98.5

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-113896838-A	Long-acting antibacterial polystyrene resin and preparation method thereof	2021-11-12
CN-113666825-A	Terminal alkene propoxy carboxylic acid monomer and preparation method and application thereof	2021-08-30
WO-2022051583-A1	Medium- or macro-cyclic benzyl-substituted heterocycle derivatives and their uses as orexin-2 receptor agonists	2020-09-03
JP-2022041414-A	Method for manufacturing coating agent composition, coating layer, coating molded product and coating layer	2020-09-01
CN-111808291-A	Amphiphilic silicon-based functional polymer and preparation method and application thereof	2020-06-24
JP-2021185399-A	Quantum dot-containing polymer and its manufacturing method	2020-05-25
WO-2021241071-A1	Quantum dot-containing polymer and method for producing same	2020-05-25
WO-2021190765-A1	Mesogen compounds	2020-03-27
JP-2021147575-A	Aqueous dispersions, paint compositions, coatings and painted articles	2020-03-23
JP-2020073708-A	Composite polymer particles and method for producing the same	2020-02-19

The molarity calculator equation

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

Mass

Concentration

Volume

Molecular Weight *

Calculate

The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

Concentration _(start)

Volume _(start)

Concentration _(final)

Volume _(final)