3-Hydroxyoctanoic Acid

CAT: 1410-M28858-02Size: 5 mgDry Ice: NoHazardous: No

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Description

3-Hydroxyoctanoic Acid is one of the hydroxy-carboxylic acids (HCAs) that serve as intermediates of energy metabolism. It is an agonist of the orphan receptor GPR109B.

CAS Number

14292-27-4

Stability

≥ 2 years

Purity

>98% (HPLC)

Weight

160.21

Molecular Formula

C8H16O3

Notes

Research use only, not for human use.

Receptor

D3 receptor

Chemical Information

3-Hydroxyoctanoic acid

3-hydroxyoctanoic acid is an 8-carbon, beta-hydroxy fatty acid which may be a marker for primary defects of beta-hydroxy fatty acid metabolism. Repeating unit of poly(3-hydroxyoctanoic acid), a biopolymer used by numerous bacterial species as carbon and energy reserves. It is a 3-hydroxy monocarboxylic acid, a medium-chain fatty acid and a 3-hydroxy fatty acid. It is functionally related to an octanoic acid. It is a conjugate acid of a 3-hydroxyoctanoate.

CAS Number	14292-27-4
PubChem CID	26613
IUPAC Name	3-hydroxyoctanoic acid
Molecular Formula	C8H16O3
Molecular Weight	160.21
XLogP	1.4
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Heavy Atom Count	11
Formal Charge	0
Complexity	112

SMILES

CCCCCC(CC(=O)O)O

InChI

InChI=1S/C8H16O3/c1-2-3-4-5-7(9)6-8(10)11/h7,9H,2-6H2,1H3,(H,10,11)

InChIKey

NDPLAKGOSZHTPH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 14292-27-4

CID: 26613

Formula: C8H16O3

MW: 160.21

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	160.21
XLogP3	1.4
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	6
Exact Mass	160.109944368
Monoisotopic Mass	160.109944368
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	112
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

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Alternative Products

Catalog	Name
014304	3-Hydroxyoctanoic Acid
sc-214136A	(±) -3-Hydroxyoctanoic acid
HY-W700715	3-Hydroxyoctanoic Acid-d12
HY-113058R	3-Hydroxyoctanoic acid (Standard)
IBA79686-01	(3S) -3-Hydroxyoctanoic acid
OR1069933-01	(R) -3-Hydroxyoctanoic acid
UBA98772-01	(3R) -3-Hydroxyoctanoic acid
HY-W129147	8-Hydroxyoctanoic acid
MBS392334-01	2-Hydroxyoctanoic Acid
TRC-H955255-500MG	7-Hydroxyoctanoic Acid

3-Hydroxyoctanoic Acid

Chemical Information

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