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Propanoicacid, 2-hydroxy-, ethyl ester, (2R)-

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Name

Propanoicacid, 2-hydroxy-, ethyl ester, (2R)-

EINECS N/A
CAS No. 7699-00-5 Density 1.05 g/cm3
PSA 46.53000 LogP -0.06970
Solubility N/A Melting Point N/A
Formula C5H10O3 Boiling Point 154.5 °C at 760 mmHg
Molecular Weight 118.133 Flash Point 54.6 °C
Transport Information UN 1192 3/PG 3 Appearance N/A
Safety 24-26-39 Risk Codes 10-37-41
Molecular Structure Molecular Structure of 7699-00-5 ((+)-ETHYL D-LACTATE) Hazard Symbols IrritantXi
Synonyms

Lacticacid, ethyl ester, D- (8CI);Propanoic acid, 2-hydroxy-, ethyl ester, (R)-;(+)-Ethyl 2-hydroxypropanoate;(+)-Ethyl 2-hydroxypropionate;(+)-Ethyllactate;(2R)-2-Hydroxypropanoic acid ethyl ester;(R)-(+)-Ethyl lactate;(R)-(+)-Lactic acid ethyl ester;(R)-2-Hydroxypropionic acid ethyl ester;(R)-Ethyl lactate;(R)-Lactic acid ethyl ester;D-Ethyl lactate;Ethyl(R)-2-hydroxypropanoate;Ethyl (R)-2-hydroxypropionate;Ethyl D-lactate;

Article Data 57

Propanoicacid, 2-hydroxy-, ethyl ester, (2R)- Synthetic route

64-17-5

ethanol

10326-41-7

D-Lactic acid

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With salicylaldehyde at 80℃; for 28h; Inert atmosphere; chemoselective reaction;85%
With sulfuric acid at 120℃; for 8h; Molecular sieve;25%
With hydrogenchloride
With sulfuric acid; benzene durch azeotrope Destillation;
64-17-5

ethanol

104196-77-2, 104264-83-7

(3R,5S,6R,9S)-3,9-Dimethyl-6-(1-methyl-1-phenyl-ethyl)-1,4-dioxa-spiro[4.5]decan-2-one

A

7699-00-5

(R)-Ethyl lactate

B

97371-54-5

(-)-(2S,5R)-5-Methyl-2-(1-methyl-1-phenylethyl)cyclohexanon

Conditions
ConditionsYield
With hydrogenchloride for 2h; Heating;A 84%
B n/a
617-35-6

2-oxo-propionic acid ethyl ester

A

687-47-8

(S)-Ethyl lactate

B

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With hydrogen; cinchonidine In cyclohexane at 24.84℃; under 30003 Torr; optical yield given as %ee; enantioselective reaction;A n/a
B 76%
With D-Glucose; cliona varians In water at 25℃; for 72h; Reagent/catalyst;A 49%
B n/a
With hydrogen; cinchonine; Pt/Al2O3 In toluene at 20℃; under 15001.2 Torr; Rate constant; Product distribution; var. conc. of HCd, solvent;
64-17-5

ethanol

13076-17-0

D-lactide

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With hydrogenchloride In toluene76%
617-35-6

2-oxo-propionic acid ethyl ester

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With glycerol dehydrogenase; 2-propanol-NAD(1+) potassium phosphate buffer, pH 7;61%
With Leifsonia sp. S749 cells alcohol dehydrogenase; nicotinamide adenine dinucleotide; isopropyl alcohol In phosphate buffer at 25℃; for 24h; pH=7.0;19%
With hydrogen; (R)-N-<2-hydroxy2-(1-naphthyl)ethyl>pyrrolidine; Pt/Al2O3 In acetic acid at 25℃; under 7500.6 Torr; for 2h; Product distribution; enantioselectivity; var. modifiers, also in the absence of modifiers, var. solvents, temp., pressure and time;
64-17-5

ethanol

18668-00-3

(R)-(+)-2-acetoxypropionic acid

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With sulfuryl dichloride at -40 - 20℃; for 48h;58%
97-64-3, 2676-33-7

ethyl 2-hydroxypropionate

A

79-33-4

L-Lactic acid

B

10326-41-7

D-Lactic acid

C

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With ammonium hydroxide at 30℃; pH=6.9;A n/a
B n/a
C 34.5%
997-04-6

2-nitryloxy-propionic acid ethyl ester

A

687-47-8

(S)-Ethyl lactate

B

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With acetic acid; zinc Yield given. Yields of byproduct given. Title compound not separated from byproducts;
20918-92-7

(R)-2-(Acetoxy)propionsaeure-ethylester

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With toluene-4-sulfonic acid In ethanol for 72h; Heating; Yield given;
90246-32-5

(1R)-2-ethoxy-1-methyl-2-oxoethyl 4-nitrobenzoate

7699-00-5

(R)-Ethyl lactate

Conditions
ConditionsYield
With potassium carbonate In ethanol at 23℃; for 15h;

Propanoicacid, 2-hydroxy-, ethyl ester, (2R)- Specification

The Propanoicacid, 2-hydroxy-, ethyl ester, (2R)-, with the CAS registry number 7699-00-5, has the systematic name of ethyl 2-hydroxypropanoate. It belongs to the product category of Acetyl Group. And the molecular formula of the chemical is C5H10O3.

The characteristics of Propanoicacid, 2-hydroxy-, ethyl ester, (2R)- are as followings: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 18.84; (5)ACD/KOC (pH 7.4): 18.84; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 46.53 Å2; (10)Index of Refraction: 1.42; (11)Molar Refractivity: 28.48 cm3; (12)Molar Volume: 112.4 cm3; (13)Polarizability: 11.29×10-24cm3; (14)Surface Tension: 33.2 dyne/cm; (15)Density: 1.05 g/cm3; (16)Flash Point: 54.6 °C; (17)Enthalpy of Vaporization: 45.57 kJ/mol; (18)Boiling Point: 154.5 °C at 760 mmHg; (19)Vapour Pressure: 1.16 mmHg at 25°C.

You should be cautious while dealing with this chemical. It is a kind of flammable chemical which irritates to respiratory system. What's more, it has risk of serious damage to eyes. Therefore, you had better take the following instructions: Avoid contact with skin; Wear eye/face protection, and if in case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: CCOC(=O)C(C)O
(2)InChI: InChI=1/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3
(3)InChIKey: LZCLXQDLBQLTDK-UHFFFAOYAV

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