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625-72-9

Basic Information
CAS No.: 625-72-9
Name: (R)-3-HYDROXYBUTYRIC ACID
Article Data: 75
Molecular Structure:
Molecular Structure of 625-72-9 ((R)-3-HYDROXYBUTYRIC ACID)
Formula: C4H8O3
Molecular Weight: 104.106
Synonyms: Butanoicacid, 3-hydroxy-, (R)-;Butyric acid, 3-hydroxy-, D-(-)- (8CI);(-)-3-Hydroxy-n-butyric acid;(-)-3-Hydroxybutyric acid;(3R)-3-Hydroxybutyricacid;(R)-(-)-3-Hydroxybutyric acid;(R)-(-)-b-Hydroxybutyric acid;(R)-3-Hydroxybutanoic acid;(R)-3-Hydroxybutyric acid;(R)-b-Hydroxybutanoic acid;(R)-b-Hydroxybutyric acid;D-(-)-3-Hydroxybutanoic acid;D-(-)-3-Hydroxybutyric acid;D-(-)-b-Hydroxybutyric acid;D-3-Hydroxybutyric acid;
EINECS: 210-909-6
Density: 1.195 g/cm3
Melting Point: 49-50 °C(lit.)
Boiling Point: 269.216 °C at 760 mmHg
Flash Point: 121.011 °C
Appearance: white crystal
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38
Safety: 26-36
PSA: 57.53000
LogP: -0.15810
Synthetic route
3976-69-0

Methyl (R)-3-hydroxybutyrate

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
Stage #1: Methyl (R)-3-hydroxybutyrate With potassium hydroxide In water at 0 - 20℃; for 48h; Inert atmosphere;
Stage #2: With hydrogenchloride In water pH=1; Inert atmosphere;
94%
With potassium hydroxide In water at 4℃; for 480h;91%
Stage #1: Methyl (R)-3-hydroxybutyrate With potassium hydroxide; water at 0℃; for 25.5h;
Stage #2: With hydrogenchloride; water at 5℃;
87%
13613-65-5

sodium (R)-3-hydroxybutyrate

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With DOWEX 50x8-200 ion-exchange resin In methanol94%
With hydrogenchloride; water pH=1;69%
With hydrogenchloride; water
24915-95-5

Ethyl (R)-3-hydroxybutanoate

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With potassium hydroxide at 0℃; for 24h;93%
With sodium hydroxide In water at 10℃; for 6h;85%
With potassium hydroxide for 12h; Ambient temperature;
77877-38-4

(3'R,4S)-3-(3'-hydroxybutanoyl)-4-(1-methylethyl)-2-oxazolidinone

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With lithium hydroxide; dihydrogen peroxide In tetrahydrofuran at 20℃; for 1h;62%
With potassium hydroxide In methanol at 0℃; for 0.75h;
poly<(R)-3-hydroxybutanoic acid>

poly<(R)-3-hydroxybutanoic acid>

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With toluene-4-sulfonic acid In methanol; 1,2-dichloro-ethane for 15h; Heating;54%
5405-41-4

ethyl 3-hydroxybutyrate

A

625-72-9

(R)-3-hydroxybutyric acid

B

56816-01-4

ethyl (S)-3-hydroxybutyrate

Conditions
ConditionsYield
With sodium hydroxide In water at 30℃; pH=6.9;A n/a
B 36.4%
4368-06-3

3-hydroxybutanenitrile

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With hydrogenchloride
25139-77-9

(S)‐3‐chlorobutanoic acid

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With water
6078-06-4

methyl 3-aminobutyrate

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With cis-nitrous acid Verseifung des Reaktionsproduktes;
126575-28-8

(S)-3-chloro-butyric acid methyl ester; methyl ester of/the/ dextrorotatory β-chloro-butyric acid

625-72-9

(R)-3-hydroxybutyric acid

Conditions
ConditionsYield
With water
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Specification

The (R)-3-Hydroxybutyric acid is an organic compound with the formula C4H8O3. The IUPAC name of this chemical is (3R)-3-hydroxybutanoic acid. With the CAS registry number 625-72-9, it is also named as 3-Hydroxybutanoic acid. The product's categories are Carboxylic Acids; Chiral Building Blocks; Organic Building Blocks.

Physical properties about (R)-3-Hydroxybutyric acid are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1; (4)ACD/KOC (pH 7.4): 1; (5)#H bond acceptors: 3; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 57.53 Å2; (9)Index of Refraction: 1.455; (10)Molar Refractivity: 23.638 cm3; (11)Molar Volume: 87.071 cm3; (12)Polarizability: 9.371×10-24cm3; (13)Surface Tension: 46.362 dyne/cm; (14)Density: 1.196 g/cm3; (15)Flash Point: 121.011 °C; (16)Enthalpy of Vaporization: 58.908 kJ/mol; (17)Boiling Point: 269.216 °C at 760 mmHg; (18)Vapour Pressure: 0.001 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: CC(CC(=O)O)O
(2)InChI: InChI=1/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)
(3)InChIKey: WHBMMWSBFZVSSR-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C4H8O3/c1-3(5)2-4(6)7/h3,5H,2H2,1H3,(H,6,7)
(5)Std. InChIKey: WHBMMWSBFZVSSR-UHFFFAOYSA-N