2-Hydroxy-3-butenoic acid

Product Information

Molecular Formula:
C4H6O3
Molecular Weight:
102.08
Description
Applications: 2-hydroxybut-3-enoic acid is a useful research chemical.
Synonyms
2-hydroxybut-3-enoic acid; Vinylglycolic acid; 2-Hydroxy-3-butenoic acid; 3-Butenoic acid, 2-hydroxy-; 2-Hydroxy-3-butenoicacid; Vinylglykolsaure; 2-hydroxybut-3-enoicacid
IUPAC Name
2-hydroxybut-3-enoic acid
Canonical SMILES
C=CC(C(=O)O)O
InChI
InChI=1S/C4H6O3/c1-2-3(5)4(6)7/h2-3,5H,1H2,(H,6,7)
InChI Key
VBWPSWWDYVWZKA-UHFFFAOYSA-N
Boiling Point
131.37°C (rough estimate)
Melting Point
43°C
Density
1.2020
Refractive Index
1.4046 (estimate)

Computed Properties

XLogP3
0
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
102.031694049 g/mol
Monoisotopic Mass
102.031694049 g/mol
Topological Polar Surface Area
57.5Ų
Heavy Atom Count
7
Formal Charge
0
Complexity
86.9
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
1
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
CN-113524937-A zero-VOC offset alcohol-free fountain solution 2021-08-03
CN-113519695-A Composite microbial inoculum for fermenting straw feed, fermented feed and preparation method 2021-07-14
WO-2022010403-A1 A radiation curable composition comprising a biobased reactive diluent 2020-07-08
EP-3798205-A1 Bio-based acrylate monomer 2019-09-26
WO-2021058292-A1 Bio-based acrylate monomer 2019-09-26
TW-202120469-A Bio-based acrylate monomer 2019-09-26
FR-3094715-A1 PROCESS FOR PREPARING A SULFUR OR SELENIA COMPOUND BY THIOLENE REACTION 2019-04-04
WO-2020201412-A1 Method for preparing a sulfur or selenised compound by thiolene reaction 2019-04-04
TW-202100509-A Method for preparing a sulfur or selenium compound by thiol-ene reaction 2019-04-04
CN-113661159-A Method for producing sulfur-containing compounds or selenium-containing compounds by reacting thiol alkenes 2019-04-04

Literatures

PMID Publication Date Title Journal
19287539 2008-01-01 Characterisation of the substrate specificity of the nitrile hydrolyzing system of the acidotolerant black yeast Exophiala oligosperma R1 Studies in mycology
11456585 2001-01-31 A QM/MM study of the racemization of vinylglycolate catalyzed by mandelate racemase enzyme Journal of the American Chemical Society
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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