S-Benzyl-L-cysteine methyl ester hydrochloride
-
S-Benzyl-L-cysteine methyl ester hydrochloride
structure -
-
CAS No:
16741-80-3
-
Formula:
C11H15NO2S.ClH
-
Chemical Name:
S-Benzyl-L-cysteine methyl ester hydrochloride
-
Synonyms:
L-Cysteine,S-(phenylmethyl)-,methyl ester,hydrochloride (1:1);Alanine,3-(benzylthio)-,methyl ester,hydrochloride,L-;L-Cysteine,S-(phenylmethyl)-,methyl ester,hydrochloride;S-Benzylcysteine hydrochloride methyl ester;S-Benzyl-L-cysteine methyl ester hydrochloride;Methyl 3-benzyl-L-cysteinate hydrochloride;L-Cysteine benzyl thioether methyl ester hydrochloride;NSC 161612;L-S-Benzylcysteine methyl ester hydrochloride;170278-52-1
- Categories:
-
CAS No:
S-Benzyl-L-cysteine methyl ester hydrochloride Basic Attributes
261.77
261.059021
240-803-5
161612|17157
2930909090
Characteristics
77.6
1.165g/cm3
160-162 °C @ Solvent: Methanol, Diethyl ether
339.8°C at 760 mmHg
159.3ºC
−20°C
S-Benzyl-L-cysteine methyl ester hydrochloride Use and Manufacturing
Synthesis OFN (L-CYANOCYCLOPROPYL)-3-PHENYLMETHANESULFONYL-2 (R)- (2, 2, 2-TRIFLUORO-1 (RS)- thiophen-2-yl-ethylamino) propionamide STEP 1 To a COLD (0° C), stirred solution of 2 (R)-amino-3-phenylmethanesulfanylpropionic acid (commercially available) (4. 01 g, 19.0 mmol) in methanol (100 mL) was introduced HCL gas for 15 min and the reaction mixture was sealed and stirring was continued at rt overnight. The solvent was then evaporated under vacuum to give methyl 2 (R)-amino-3-phenylmethane- sulfanylpropionate HCL in quantitative yield (4.98 g).To a solution of compound 7 (1 g, 5 mmol) in methanol (30 mL) at 0 °C was dropped SOCl2 (1.5 mL, 7 mmol) and then the mixture was stirred at room temperature for 6 h. Methanol was evaporated to give 8 as a white solid (1.3 g, 85percent), mp 148-150 °C (lit [37].: 160-162 °C; lit. [38].: 151-152 °C). 1H NMR (400 MHz, CDCl3) δ 7.23-7.32 (m, 5H, Ar-H), 3.73 (s, 2H, -CH2Ph), 3.72 (s, 3H, -COOCH3), 3.58-3.61 (m, 1H, H-2), 2.80-2.85 (m, 1H, H-3), 2.64-2.69 (m, 1H, H-3).
Computed Properties
Molecular Weight:261.77
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:261.0590276
Monoisotopic Mass:261.0590276
Topological Polar Surface Area:77.6
Heavy Atom Count:16
Complexity:193
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
Recommended Suppliers of S-Benzyl-L-cysteine methyl ester hydrochloride
-
![China]()
CN
6 YRS
Business licensed Certified factoryManufactory Supplier of Pharmaceutical Peptide,Cosmetic peptide,Custom peptides,API polypeptide,Amino acids and derivatives -
![China]()
CN
5 YRS
Business licensedTrader Supplier of Intermediates,Building blocks,API,Silicones,Peptides,Lab chemicals,Biochemicals,Pharmaceuticals,Screening Compounds,Food Additives
Learn More Other Chemicals
-
Cyclopentanecarboxylic acid, 2-(hydroxyimino)-, methyl ester (9CI)
170016-09-8
-
Cysteine, 2-methyl-, methyl ester (9CI)
778548-47-3
-
D-Glucuronal 3,4-Diacetate Methyl Ester
34296-99-6
-
3-(2,6-DICHLORO-PHENYL)-5-ISOPROPYL-ISOXAZOLE-4-CARBOXYLIC ACID METHYL ESTER Formula
278597-28-7
-
D-glycero-D-gulo-Heptonic acid, 5-amino-2,6-anhydro-5-deoxy-, methyl ester (9CI) Formula
761345-72-6
-
Cyclohexanepropanoic acid, methyl ester Formula
20681-51-0
-
3α,7β-Diacetoxy-5β-cholan-24-oic acid methyl ester Structure
60384-30-7
-
5,6-DIAMINOPYRIDINE-3-CARBOXYLIC ACID METHYL ESTER Structure
104685-76-9
-
What is 3-(5-BROMO-THIOPHEN-2-YL)-ACRYLIC ACID METHYL ESTER
64389-22-6
-
What is Butanoic acid, 2-fluoro-3-Methyl-, Methyl ester
135359-27-2
S-Benzyl-L-cysteine methyl ester hydrochloride
SDSRequest for Quotation