Levulinic acid (Standard)

CAT: 0804-HY-Y0839R-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:0804-HY-Y0839R-01Size:10 mg

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Description

Levulinic acid (Standard) is the analytical standard of Levulinic acid. This product is intended for research and analytical applications. Levulinic acid is a precursor for the synthesis of biofuels, such as ethyl levulinate.

CAS Number

123-76-2

Product Name Alternative

4-Oxovaleric acid (Standard) ; NSC 3716 (Standard) ; (Standard)

UNSPSC

12352211

Hazard Statement

H302, H314, H315, H319, H335

Target

Bacterial; Endogenous Metabolite; Reference Standards

Type

Reference Standards

Related Pathways

Anti-infection; Metabolic Enzyme/Protease; Others

Field of Research

Others

Assay Protocol

https://www.medchemexpress.com/levulinic-acid-standard.html

Purity

99.27

Smiles

CC(CCC(O)=O)=O

Molecular Formula

C5H8O3

Molecular Weight

116.12

Precautions

H302, H314, H315, H319, H335

References & Citations

[1]Pileidis FD, et al. Levulinic Acid Biorefineries: New Challenges for Efficient Utilization of Biomass. ChemSusChem. 2016 Mar 21;9 (6) :562-82.

Shipping Conditions

Blue Ice

Storage Conditions

4°C, sealed storage, away from light and moisture

Scientific Category

Reference Standards

Chemical Information

Levulinic Acid

4-oxopentanoic acid is an oxopentanoic acid with the oxo group in the 4-position. It has a role as a plant metabolite. It is an oxopentanoic acid and a straight-chain saturated fatty acid. It is a conjugate acid of a 4-oxopentanoate.

CAS Number	123-76-2
PubChem CID	11579
IUPAC Name	4-oxopentanoic acid
Molecular Formula	C5H8O3
Molecular Weight	116.11
XLogP	-0.5
Topological Polar Surface Area	54.4
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Heavy Atom Count	8
Formal Charge	0
Complexity	106

SMILES

CC(=O)CCC(=O)O

InChI

InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)

InChIKey

JOOXCMJARBKPKM-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 123-76-2

CID: 11579

Formula: C5H8O3

MW: 116.11

Interactive 3D Structure

Loading 3D structure...

View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	116.11
XLogP3	-0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	116.047344113
Monoisotopic Mass	116.047344113
Topological Polar Surface Area	54.4 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	106
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

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L02995-01	Levulinic acid oxime

Levulinic acid (Standard)

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