(R) -3-Hydroxybutyric acid

CAT: 0926-FH30134-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-FH30134-01Size:1 g

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CAS Number

625-72-9

MDL Number

MFCD00066257

Smiles

C[C@H] (CC (=O) O) O

Molecular Formula

C4H8O3

Molecular Weight

104.1 g/mol

Controlled

Chemical Information

3-Hydroxybutanoic acid, (R)-

(R)-3-hydroxybutyric acid is the R-enantiomer of 3-hydroxybutyric acid. Involved in the synthesis and degradation of ketone bodies, it can be used as an energy source by the brain during hypoglycaemia, and for the synthesis of biodegradable plastics. It is a sex pheremone in the European spider Linyphia triangularis. It has a role as a pheromone, a fungal metabolite and a human metabolite. It is a 3-hydroxybutyric acid and a ketone body. It is a conjugate acid of a (R)-3-hydroxybutyrate. It is an enantiomer of a (S)-3-hydroxybutyric acid.

CAS Number	625-72-9
PubChem CID	92135
IUPAC Name	(3R)-3-hydroxybutanoic acid
Molecular Formula	C4H8O3
Molecular Weight	104.10
XLogP	-0.5
Topological Polar Surface Area	57.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	7
Formal Charge	0
Complexity	69

SMILES

C[C@H](CC(=O)O)O

InChI

InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)/t3-/m1/s1

InChIKey

WHBMMWSBFZVSSR-GSVOUGTGSA-N

Chemical Structure

2D Structure

CAS: 625-72-9

CID: 92135

Formula: C4H8O3

MW: 104.10

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	104.10
XLogP3	-0.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	104.047344113
Monoisotopic Mass	104.047344113
Topological Polar Surface Area	57.5 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	69.3
Isotope Atom Count	0
Defined Atom Stereocenter Count	1
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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Catalog	Name
HY-113378-01	3-Hydroxybutyric acid
GK7020-25mg	(R) -3-Hydroxybutyric acid
sc-236812	(S) -3-Hydroxybutyric acid
S1031-01	3-Hydroxybutyric acid (BHB)
A19159-500	3-Hydroxybutyric acid 500mg
A19159-100	3-Hydroxybutyric acid 100mg
M35854-01	3-Hydroxybutyric acid sodium
HY-113378R-01	3-Hydroxybutyric acid (Standard)
HY-W010452-01	3-Hydroxybutyric acid (sodium)
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(R) -3-Hydroxybutyric acid

Chemical Information

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