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2133-40-6

Basic Information
CAS No.: 2133-40-6
Name: Methyl L-prolinate hydrochloride
Article Data: 134
Molecular Structure:
Molecular Structure of 2133-40-6 (Methyl L-prolinate hydrochloride)
Formula: C6H12ClNO2
Molecular Weight: 165.62
Synonyms: L-Proline,methyl ester, hydrochloride (9CI);Proline, methyl ester, hydrochloride, L-(6CI,7CI,8CI);(2S)-(Methoxycarbonyl)pyrrolidine hydrochloride;(S)-Methylpyrrolidine-2-carboxylate hydrochloride;(S)-Pyrrolidine-2-carboxylic acid methyl ester hydrochloride;L-Proline methyl ester monohydrochloride;Methyl proline hydrochloride;H-Pro-OMe.HCl;H-Pro-OMe·HCl;L-Proline, methylester, hydrochloride (1:1);
EINECS: 218-363-0
Density: 1.055 g/cm3
Melting Point: 69-71 °C(lit.)
Boiling Point: 169.9 °C at 760 mmHg
Flash Point: 56.5 °C
Appearance: crystalline
Hazard Symbols: IrritantXi
Risk Codes: 36/38
Safety: 26-37/39
PSA: 38.33000
LogP: 1.04220
Synthetic route
67-56-1

methanol

147-85-3

L-proline

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
With thionyl chloride for 1.5h; Heating;100%
With hydrogenchloride for 4h; Ambient temperature;100%
With thionyl chloride for 1.5h; Heating;100%
147-85-3

L-proline

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
With thionyl chloride In methanol at 20℃;100%
With sulfuryl dichloride; trimethyl orthoformate In methanol
With sulfuryl dichloride; trimethyl orthoformate In methanol
With sulfuryl dichloride; trimethyl orthoformate In methanol
5211-23-4

N-carbobenzyloxy-L-proline methyl ester

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
With hydrogen; palladium on activated charcoal In ethanol; ethyl acetate at 80℃; under 750.075 Torr;99%
59936-29-7

(S)-N-(tert-butoxycarbonyl)proline methyl ester

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
With aluminium chloride doped on a neutral alumina for 0.0166667h; Irradiation;88%
With thionyl chloride In methanol at 0 - 75℃; for 1.5h;86%
With hydrogenchloride In ethyl acetate at 15℃; for 2h;
67-56-1

methanol

15761-39-4

1-(tert-butoxycarbonyl)-L-proline

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
Stage #1: methanol; 1-(tert-butoxycarbonyl)-L-proline With thionyl chloride at 70℃; for 7.5h; Inert atmosphere; Cooling with ice;
Stage #2: With hydrogenchloride In dichloromethane; ethyl acetate at 20℃; for 0.0833333h; Inert atmosphere;
88%
Stage #1: methanol; 1-(tert-butoxycarbonyl)-L-proline With thionyl chloride at 70℃; for 7.5h; Cooling with ice;
Stage #2: With hydrogenchloride In dichloromethane; ethyl acetate at 20℃; for 0.0833333h;
88%
67-56-1

methanol

147-85-3

L-proline

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
With thionyl chloride Ambient temperature;
67-56-1

methanol

175446-63-6

proline acid chloride

2133-40-6

L-proline methyl ester monohydrochloride

147-85-3

L-proline

74-88-4

methyl iodide

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
Stage #1: L-proline With thionyl chloride
Stage #2: methyl iodide
147-85-3

L-proline

3-CH3O-phenyl halide

3-CH3O-phenyl halide

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: SOCl2
View Scheme
2577-48-2

methyl (2S)-pyrrolidine carboxylate

2133-40-6

L-proline methyl ester monohydrochloride

Conditions
ConditionsYield
With hydrogenchloride In water
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Chemistry

The Molecular Structure of L-Proline methyl ester hydrochloride (CAS NO.2133-40-6):

Empirical Formula: C6H12ClNO2
Molecular Weight: 165.618 
IUPAC Name: methyl pyrrolidine-2-carboxylate hydrochloride    
Appearance: Crystalline
Nominal Mass: 165 Da
Average Mass: 165.618 Da
Monoisotopic Mass: 165.055656 Da 
Flash Point: 56.5 °C 
Melting Point: 69-71 °C 
Enthalpy of Vaporization: 40.63 kJ/mol
Boiling Point: 169.9 °C at 760 mmHg
Vapour Pressure: 1.51 mmHg at 25°C 
Synonyms: H-l-pro-ome hcl ; H-pro-ome hcl ; Methyl l-prolinate hydrochloride ; L-pyrrolidine-2-carboxylic acid methyl ester hcl ; L-proline methyl ester hydrochloride ; L-proline methyl ester hydrochloride salt ; Proline-ome hcl ; L-proline methyl ester hcl     
Product Categories: AMINOACIDS DERIVATIVES;Esters;Pyrrolidines;Amino Acid Derivatives;Amino Acids;Proline [Pro, P];Amino Acids and Derivatives;Amino hydrochloride;Peptide Synthesis;Amino Acid Derivatives;Proline

Toxicity Data With Reference

RTECS#: CAS# 2133-40-6 unlisted.
LD50/LC50: Not available.
Carcinogenicity: l-PROLINE methyl ester hydrochloride -Not listed by ACGIH, IARC, or NTP.

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/38 
R36/38: Irritating to eyes and skin
Safety Statements: 26-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
S37/39: Wear suitable gloves and eye/face protection
WGK Germany: 3
F: 3-8-10-21
Hazard Note: Harmful

Specification

Conditions to Avoid: Incompatible materials, dust generation, excess HEAT, exposure to moist air or WATER.
Incompatibilities with Other Materials: Strong oxidizing agents.
Hazardous Decomposition Products: Hydrogen chloride, NITROGEN oxides, CARBON monoxide, irritating and toxic fumes and gases, CARBON dioxide.
Hazardous Polymerization: Has not been reported