Ethyl (S)-3-hydroxybutyrate supplier

Name
Ethyl (S)-3-hydroxybutyrate
EINECS 260-393-1
CAS No. 56816-01-4
Article Data124
CAS DataBase
Density 1.024 g/cm³
Solubility
Melting Point
Formula C₆H₁₂O₃
Boiling Point 175 °C at 760 mmHg
Molecular Weight 132.159
Flash Point 64.4 °C
Transport Information
Appearance clear colorless liquid
Safety 23-24/25
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Butanoicacid, 3-hydroxy-, ethyl ester, (S)-;(+)-Ethyl 3-hydroxybutyrate;(3S)-3-Hydroxybutyric acid ethyl ester;(S)-(+)-3-Hydroxy-n-butyrate ethylester;(S)-(+)-Ethyl 3-hydroxybutanoate;(S)-(+)-Ethyl 3-hydroxybutyrate;(S)-3-Hydroxybutanoic acid ethyl ester;(S)-3-Hydroxybutyric acid ethyl ester;(S)-Ethyl 3-hydroxybutyrate;Ethyl (+)-3-hydroxybutanoate;Ethyl (S)-(+)-b-hydroxybutyrate;Ethyl(S)-3-hydroxybutanoate;Ethyl (S)-3-hydroxybutyrate;
PSA 46.53000
LogP 0.32040

Synthetic route

: 141-97-9
ethyl acetoacetate

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With [NEt2H2]-[{RuCl(S)-BINAP}2(μ-Cl)3]; hydrogen In methanol; ethanol at 50℃; under 22801.5 Torr; for 12h; Inert atmosphere; Autoclave; optical yield given as %ee;	100%
With hydrogen In ethanol at 80℃; under 15001.5 Torr; for 10h; enantioselective reaction;	99.5%
With C32H40F6O6P2Pd; hydrogen In acetone at 0℃; under 23272.3 Torr; for 12h; Autoclave; enantioselective reaction;	99%

: 5405-41-4
ethyl 3-hydroxybutyrate

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With alcohol dehydrogenase from Lactobacillus kefir; alcohol dehydrogenase from Rhodococcus ruber DSM 44541; YcnD-oxidoreductase at 30℃; for 6h; pH=7.5; aq. buffer; Resolution of racemate; Enzymatic reaction; optical yield given as %ee; enantiospecific reaction;	99%
With Alcaligenes faecalis DSM 13975 cells; alcohol dehydrogenase from Rhodococcus erythropolis; glucose dehydrogenase BS; D-glucose; nicotinamide adenine dinucleotide In alkaline aq. solution at 30℃; for 16h; pH=7.5;

: 105729-39-3
ethyl (3S)-3-{[tert-butyl(dimethyl)silyl]oxy}butanoate

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With cerium(III) chloride; sodium iodide In acetonitrile for 3h; Heating;	95%

: 64-17-5
ethanol

: 201230-82-2
carbon monoxide

: 16088-62-3
(S)-Propylene oxide

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With hydrogen; 4-aminopyridine; dicobalt octacarbonyl at 40℃; under 7500.75 Torr; for 24h;	92%
With 1,1-dimethyl-3,3-diethylguanidinecarbonylcobalt at 80℃; under 45004.5 Torr; for 24h; Autoclave;

...Expand

: 81378-01-0
ethyl (+/-)-3-(3',5'-dinitrobenzoyloxy)butanoate

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With titanium(IV) tetraethanolate In ethanol at 78℃; for 96h;	90%

: 79427-05-7
(S)-3-(3',5'-Dinitrobenzoyloxy)-buttersaeureaethylester

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With potassium hydroxide In tetrahydrofuran; ethanol	90%
With potassium hydroxide In tetrahydrofuran; ethanol at -5 - 0℃; for 1h;	89%
With potassium hydroxide	79%
With potassium hydroxide In tetrahydrofuran; ethanol at 0℃; for 0.833333h;	113 mg

: 64-17-5
ethanol

: C10H10N2O7

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With titanium(IV) isopropylate for 2h; Inert atmosphere; Reflux;	90%

: 64-17-5
ethanol

: 809275-92-1
N-(3-hydroxy-butyryl)-benzamide

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With erbium(III) triflate at 4℃; for 20h;	89%

: 64-17-5
ethanol

: 16493-63-3
(R)-(-)-3-hydroxy-4,4,4-trichlorobutyric β-lactone

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 10488-69-4, 86728-85-0, 87068-18-6, 90866-33-4
ethyl (L)-4-chloro-3-hydroxybutyrate

Conditions

Conditions	Yield
With hydrogen; potassium acetate; palladium on activated charcoal at 25℃; for 80h;	A n/a B 88%

...Expand

: 141-97-9
ethyl acetoacetate

A: 24915-95-5
Ethyl (R)-3-hydroxybutanoate

B: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With citrate-phosphate-borate buffer for 24h; Ambient temperature; baker's yeast immobilized in calcium alginate; Title compound not separated from byproducts;	A n/a B 85%
With Convolvulus sepium for 120h; pH=5.8; aq. phosphate buffer; optical yield given as %ee;	A n/a B 70%
yeast Conversion of starting material; Enzymatic reaction;	A n/a B 26%

: 5405-41-4
ethyl 3-hydroxybutyrate

: 123-20-6
vinyl n-butyrate

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 3-Butyryloxy-butyric acid ethyl ester

Conditions

Conditions	Yield
With 4 Angstroem MS; porcin pancreatic lipase In toluene 1.) 37 deg C, 16 h; 2.) 55 deg C, 24 h;	A 83% B n/a
lipase P from Pseudomonas In toluene at 65℃; for 42h;	A 80.5% B n/a

...Expand

: 126434-58-0
(-)-(R)-Ethyl 3-(mesyloxy)butanoate

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With calcium carbonate In water at 80℃; for 3h; Inert atmosphere;	82%
With water; calcium carbonate	70%

: 64-17-5
ethanol

: 6168-83-8
(S)-3-Hydroxybutanoic Acid

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With sulfuric acid	73%
With sulfuric acid	73%

: C6H12O4S

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With hydrogen; Raney-Ni (W4) In ethanol	68%

: 107290-90-4
(S)-3-Hydroxy-dithiobutyric acid methyl ester

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With CuCl2-CuO In ethanol for 24h; Ambient temperature;	62%

: 79427-02-4
(2E,4E)-7-(t-Butyl-dimethylsilyloxy)-2,4-octadiensaeuremethylester

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: (2E,4E)-7-(t-Butyl-dimethylsilyloxy)-2,4-octadiensaeure

Conditions

Conditions	Yield
With hydrogenchloride In tetrahydrofuran at 30℃; for 3h;	A 58% B 22%

: 64-17-5
ethanol

: 77669-83-1
(S)-3-(1-ethoxyethoxy)butyronitrile

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With hydrogenchloride; water for 3h;	47%
With hydrogenchloride

: 81327-44-8
3-(Naphthalen-1-ylcarbamoyloxy)-butyric acid ethyl ester

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With titanium(IV) tetraethanolate In ethanol at 130℃; under 3800 Torr; for 120h;	45%

: 609-15-4
ethyl 2-chloro-3-oxo-butyrate

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 110444-43-4
ethyl (2R,3S)-2-chloro-3-hydroxybutanoate

Conditions

Conditions	Yield
Baker's yeast;	A n/a B 40%

: 5405-41-4
ethyl 3-hydroxybutyrate

A: 625-72-9
(R)-3-hydroxybutyric acid

B: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With sodium hydroxide In water at 30℃; pH=6.9;	A n/a B 36.4%

: 141-97-9
ethyl acetoacetate

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 29267-46-7
3,3-bismethoxybutyric acid methyl ester

Conditions

Conditions	Yield
With <(-)-2,2'-bis(diphenylphosphino)-3,3'-bibenzothiophene>RuCl2; hydrogen In methanol at 70℃; under 73550.8 Torr; for 2h; Yield given;	A n/a B 5%

: 5405-41-4
ethyl 3-hydroxybutyrate

A: 24915-95-5
Ethyl (R)-3-hydroxybutanoate

B: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
Yield given. Yields of byproduct given. Title compound not separated from byproducts;
With pentyl cage-coated capillary column Resolution of racemate;
With homochiral metal-organic cage [Zn3(deprotonated [3+3] macrocyclic Schiff base of trans-1,2-diaminocyclohexane and 4-tert-butyl-2,6-diformylphenol)2] coated capillary column In dichloromethane at 118℃; Resolution of racemate; enantioselective reaction;

: 141-97-9
ethyl acetoacetate

A: 6168-83-8
(S)-3-Hydroxybutanoic Acid

B: 625-72-9
(R)-3-hydroxybutyric acid

C: 24915-95-5
Ethyl (R)-3-hydroxybutanoate

D: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With Halobacterium halobium; pepton; potassium chloride; water; sodium citrate; magnesium sulfate; sodium chloride at 40℃; for 120h; Irradiation; Yields of byproduct given. Title compound not separated from byproducts;
With Halobacterium halobium; pepton; potassium chloride; sodium citrate; magnesium sulfate; sodium chloride In water at 40℃; for 120h; Irradiation; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

...Expand

: 100009-46-9
ethyl 3-nitro-oxy-butanoate

A: 24915-95-5
Ethyl (R)-3-hydroxybutanoate

B: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With hydrogen; palladium on activated charcoal In methanol Yield given. Yields of byproduct given. Title compound not separated from byproducts;

: (S)-3-Hydroxy-2-methanesulfinyl-butyric acid ethyl ester

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With aluminum amalgam Yield given;
With aluminium amalgam Yield given;

: 166896-25-9
ethyl (3R)-4,4,4-trichloro-3-hydroxybutanoate

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
With hydrogen; potassium carbonate; palladium on activated charcoal In methanol under 2280 Torr;

: 64-17-5
ethanol

: 16493-63-3
(R)-(-)-3-hydroxy-4,4,4-trichlorobutyric β-lactone

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 10488-69-4, 86728-85-0, 87068-18-6, 90866-33-4
ethyl (L)-4-chloro-3-hydroxybutyrate

C: ethyl (R)-3-hydroxy-4,4-dichlorobutyrate

Conditions

Conditions	Yield
With hydrogen; potassium acetate; palladium on activated charcoal at 25℃; for 80h; Product distribution; other reagents, catalysts, and reaction times;	A 7 % Chromat. B 87 % Chromat. C 6 % Chromat.

...Expand

: 64-17-5
ethanol

poly[(R)-hydroxybutyrate] BIOPOL D300G: poly[(R)-hydroxybutyrate] BIOPOL D300G

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 54074-85-0, 73143-60-9, 122673-73-8, 73143-67-6
ethyl (S)-3-hydroxyvalerate

C: 623-70-1
ethyl (E)-crotonate

Conditions

Conditions	Yield
Multistep reaction. Title compound not separated from byproducts;

...Expand

: 123-73-9
trans-Crotonaldehyde

: 64-17-5
ethanol

A: 24915-95-5
Ethyl (R)-3-hydroxybutanoate

B: 56816-01-4
ethyl (S)-3-hydroxybutyrate

Conditions

Conditions	Yield
Stage #1: trans-Crotonaldehyde; ethanol With dihydrogen peroxide In chloroform at -20℃; for 16h; Stage #2: With N-ethyl-N,N-diisopropylamine In chloroform at 30℃; for 15h; Further stages. Title compound not separated from byproducts.;

...Expand

: 108-22-5
Isopropenyl acetate

: 5405-41-4
ethyl 3-hydroxybutyrate

A: 56816-01-4
ethyl (S)-3-hydroxybutyrate

B: 114592-78-8
(R)-3-Acetoxybuttersaeure-ethylester

C: (S)-ethyl 3-acetoxybutanoate

Conditions

Conditions	Yield
With Candida antarctica lipase B at 23℃; Title compound not separated from byproducts.;

...Expand

: 110-87-2
3,4-dihydro-2H-pyran

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 79016-08-3
(3S)-3-<<(2R,S)-3,4,5,6-Tetrahydro-2H-pyran-2-yl>oxy>buttersaeure-ethylester

Conditions

Conditions	Yield
	100%
With pyridinium p-toluenesulfonate In dichloromethane for 2.5h; Reflux;	98%
With toluene-4-sulfonic acid In diethyl ether 1.) 0 deg C, 2.5 h, 2.) RT, 0.5 h;	97%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 18162-48-6
tert-butyldimethylsilyl chloride

: 105729-39-3
ethyl (3S)-3-{[tert-butyl(dimethyl)silyl]oxy}butanoate

Conditions

Conditions	Yield
With 1H-imidazole In dichloromethane at 0 - 23℃;	100%
With 1H-imidazole In dichloromethane at 20℃; for 12h;	100%
With 1H-imidazole In dichloromethane at 0 - 20℃; Inert atmosphere;	98%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 109-92-2
ethyl vinyl ether

: 82614-86-6
(3S)-3-(1'-Aethoxyaethoxy)buttersaeure-aethylester

Conditions

Conditions	Yield
With trifluoroacetic acid for 48h; Ambient temperature;	98%
With trifluoroacetic acid 1.) a) -5 deg C, 18 h, b) 20 deg C, 2 h;	93%
trifluoroacetic acid 0 deg C, 2 h, then 5 deg C, 16 h;

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 3188-13-4
ethyl chloromethyl ether

: 137645-28-4
(S)-ethyl 3-(ethoxymethoxy)butanoate

Conditions

Conditions	Yield
With N-ethyl-N,N-diisopropylamine In dichloromethane at 0 - 20℃; for 17h; Inert atmosphere;	98%
	90%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 58479-61-1
tert-butylchlorodiphenylsilane

: 956225-28-8
C22H30O3Si

Conditions

Conditions	Yield
With 1H-imidazole In dichloromethane at 20℃; for 18h;	97%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 124-63-0
methanesulfonyl chloride

: 135587-63-2
(S)-ethyl 3-mesyloxybutyrate

Conditions

Conditions	Yield
With triethylamine In dichloromethane at 0℃; for 2h;	96.07%
With triethylamine In dichloromethane at 0 - 25℃; for 2h; Inert atmosphere;

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 89226-47-1
L(+)-3-hydroxy-butyric acid hydrazide

Conditions

Conditions	Yield
With hydrazine hydrate In ethanol; water for 1h; Heating;	94%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 74-88-4
methyl iodide

: 78088-28-5
ethyl (2S,3S)-3-hydroxy-2-methylbutanoate

Conditions

Conditions	Yield
Stage #1: ethyl (S)-3-hydroxybutyrate With lithium diisopropyl amide In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; hexane at -78 - -40℃; Frater-Seebach alkylation; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; hexane at -78 - 0℃; for 2h; Frater-Seebach alkylation; Inert atmosphere;	92%
Stage #1: ethyl (S)-3-hydroxybutyrate With lithium diisopropyl amide In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; hexane at -78 - -40℃; Frater-Seebach alkylation; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; hexane at -78 - 0℃; for 2h; Frater-Seebach alkylation; Inert atmosphere; optical yield given as %de;	92%
Stage #1: ethyl (S)-3-hydroxybutyrate With N,N,N,N,N,N-hexamethylphosphoric triamide; lithium diisopropyl amide In tetrahydrofuran; hexane at -78 - -40℃; for 0.333333h; Inert atmosphere; Stage #2: methyl iodide In tetrahydrofuran; hexane at -78 - 0℃; for 3h; Inert atmosphere;	82%

: 109-87-5
Dimethoxymethane

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 73267-69-3
ethyl (3S)-3-(methoxymethoxy)butanoate

Conditions

Conditions	Yield
With iodine; allyl-trimethyl-silane at 20℃; transacetalization;	90%
With iodine; allyl-trimethyl-silane at 20℃;

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 107-88-0, 6290-03-5, 18826-95-4, 24621-61-2
(+)-butane-1,3-diol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In tetrahydrofuran for 30h; Heating;	89%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 107-30-2
chloromethyl methyl ether

: 73267-69-3
ethyl (3S)-3-(methoxymethoxy)butanoate

Conditions

Conditions	Yield
With N,N-diethylaniline at 25℃; for 72h;	89%
With N-ethyl-N,N-diisopropylamine In dichloromethane at 0℃;	84%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 350848-02-1
2-[(4-methoxybenzyl)oxy]-3-nitropyridine

: 170649-26-0
(S)-3-(4-Methoxy-benzyloxy)-butyric acid ethyl ester

Conditions

Conditions	Yield
With trimethylsilyl trifluoromethanesulfonate In dichloromethane at 20℃; for 0.166667h;	89%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 220235-77-8
4-methoxybenzyl-2-pyridylthio carbonate

: 170649-26-0
(S)-3-(4-Methoxy-benzyloxy)-butyric acid ethyl ester

Conditions

Conditions	Yield
With silver trifluoromethanesulfonate In dichloromethane for 0.666667h; Ambient temperature;	88%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 81927-55-1
O-benzyl 2,2,2-trichloroacetimidate

: 112068-33-4
(R)-3-(benzyloxy)butanoic acid ethyl ester

Conditions

Conditions	Yield
With trifluorormethanesulfonic acid In dichloromethane; cyclohexane at 20℃; for 1h;	87%
With trifluorormethanesulfonic acid In dichloromethane; cyclohexane for 36h; Ambient temperature;	83%
With trifluorormethanesulfonic acid	78%

: 540-88-5
acetic acid tert-butyl ester

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 97037-72-4, 125404-66-2, 125404-65-1
(+)-(5S)-hydroxy-5-oxo-3-hexanoate de tert-butyle

Conditions

Conditions	Yield
With lithium diisopropyl amide In tetrahydrofuran Claisen condensation;	86%
With lithium diisopropyl amide 1.) THF/hexane, -75 deg C, 20 min, 2.) THF, -50 deg C, 2 h; Yield given. Multistep reaction;

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 73574-05-7
(2S,1'S)-2-(1-hydroxyethyl)-pent-4-enoate d'ethyle

Conditions

Conditions	Yield
	85.2%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 106-95-6
allyl bromide

: 73574-05-7
(2S,1'S)-2-(1-hydroxyethyl)-pent-4-enoate d'ethyle

Conditions

Conditions	Yield
With lithium hexamethyldisilazane In tetrahydrofuran at -70℃; Inert atmosphere;	85%
	80%
(i) LDA, THF, (ii) /BRN= 605308/, HMPT; Multistep reaction;

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 100-39-0
benzyl bromide

: 112068-33-4
(R)-3-(benzyloxy)butanoic acid ethyl ester

Conditions

Conditions	Yield
With silver(l) oxide In diethyl ether at 40℃; Inert atmosphere;	85%
With silver(l) oxide In diethyl ether	31%

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 24621-61-2
1,3-butanediol

Conditions

Conditions	Yield
With lithium aluminium tetrahydride In diethyl ether for 6h;	85%
With lithium aluminium tetrahydride In diethyl ether	82%
With lithium borohydride In methanol; diethyl ether at 20℃; Cooling with ice;	74%
With lithium aluminium tetrahydride In tetrahydrofuran for 2.5h; Ambient temperature;	66%
With lithium aluminium tetrahydride In tetrahydrofuran

: 56816-01-4
ethyl (S)-3-hydroxybutyrate

: 98-59-9
p-toluenesulfonyl chloride

: 100009-40-3
ethyl (S)-3-tosyloxy-butanoate

Conditions

Conditions	Yield
With pyridine; dmap at 0 - 20℃; for 5.5h;	85%
With pyridine In chloroform	78%
With pyridine In chloroform at 0℃; for 12h;

Ethyl (S)-3-hydroxybutyrate Specification

This chemical is called Ethyl (S)-3-hydroxybutyrate, and its CAS registry number is 56816-01-4. With the molecular formula of C₆H₁₂O₃, its product categories are Alcohols, Hydroxy Esters and Derivatives; Chiral Compounds; Chiral Building Blocks; Simple Alcohols (Chiral); Synthetic Organic Chemistry; Organic Building Blocks; Chiral Alcohols. In addition, this chemical should be sealed in the cool and dry place.

Other characteristics of the Ethyl (S)-3-hydroxybutyrate can be summarised as followings: (1)ACD/LogP: -0.02; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 35.53 Å²; (7)Index of Refraction: 1.427; (8)Molar Refractivity: 33.11 cm³; (9)Molar Volume: 128.9 cm³; (10)Polarizability: 13.12×10^-24cm³; (11)Surface Tension: 33.2 dyne/cm; (12)Density: 1.024 g/cm³; (13)Flash Point: 64.4 °C; (14)Enthalpy of Vaporization: 47.89 kJ/mol; (15)Boiling Point: 175 °C at 760 mmHg; (16)Vapour Pressure: 0.362 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: Don't breathe vapour. Avoid contacting with skin and eyes.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC)C[C@@H](O)C
2.InChI: InChI=1/C6H12O3/c1-3-9-6(8)4-5(2)7/h5,7H,3-4H2,1-2H3/t5-/m0/s1
3.InChIKey: OMSUIQOIVADKIM-YFKPBYRVBT

Product Name

Ethyl (S)-3-hydroxybutyrate

Synthetic route

Ethyl (S)-3-hydroxybutyrate Specification

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