(R)-2-((2-Benzamidopropanoyl)thio)acetic acid

Base Information

Chemical Name:(R)-2-((2-Benzamidopropanoyl)thio)acetic acid
CAS No.:138079-74-0
Molecular Formula:C₁₂H₁₃NO₄S
Molecular Weight:267.306
Hs Code.:2930909090
European Community (EC) Number:840-326-8
Nikkaji Number:J796.418H
ChEMBL ID:CHEMBL315314
Mol file:138079-74-0.mol

Synonyms:benzoyl-alanyl-thioglycolate;benzoyl-alanyl-thioglycolic acid;Bz-Ala-SG

Suppliers and Price of (R)-2-((2-Benzamidopropanoyl)thio)acetic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Crysdot
(R)-2-((2-Benzamidopropanoyl)thio)aceticacid 95+%
1g
$ 772.00

Atlantic Research Chemicals
[(N-Benzoyl-D-alanyl)sulfanyl]aceticacid 85%
1gm:
$ 703.38

American Custom Chemicals Corporation
CARBOXYMETHYL-N-BENZOYLTHIOLALANINATE 95.00%
5MG
$ 497.93

American Custom Chemicals Corporation
CARBOXYMETHYL-N-BENZOYLTHIOLALANINATE 95.00%
1G
$ 1575.00

Ambeed
(R)-2-((2-Benzamidopropanoyl)thio)aceticacid 95%
1g
$ 628.00

Ambeed
(R)-2-((2-Benzamidopropanoyl)thio)aceticacid 95%
250mg
$ 248.00

Ambeed
(R)-2-((2-Benzamidopropanoyl)thio)aceticacid 95%
100mg
$ 169.00

Ambeed
(R)-2-((2-Benzamidopropanoyl)thio)aceticacid 95%
50mg
$ 136.00

Total 17 raw suppliers

Chemical Property of (R)-2-((2-Benzamidopropanoyl)thio)acetic acid

Chemical Property:

Vapor Pressure:1.54E-11mmHg at 25°C
Boiling Point:433°Cat760mmHg
PKA:3.07±0.10(Predicted)
Flash Point:215.7°C
PSA：108.77000
Density:g/cm³
LogP:1.54020
Storage Temp.:2-8°C(protect from light)
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:267.05652907
Heavy Atom Count:18
Complexity:326

Purity/Quality:

99%, ^*data from raw suppliers

(R)-2-((2-Benzamidopropanoyl)thio)aceticacid 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C(=O)SCC(=O)O)NC(=O)C1=CC=CC=C1
Isomeric SMILES:C[C@H](C(=O)SCC(=O)O)NC(=O)C1=CC=CC=C1

Technology Process of (R)-2-((2-Benzamidopropanoyl)thio)acetic acid

There total 9 articles about (R)-2-((2-Benzamidopropanoyl)thio)acetic acid which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 85.0%

: (R)-tert-butyl 2-(2-benzamidopropanoylthio)acetate

: 138079-74-0
(R)-2-(2-benzamidopropanoylthio)acetic acid

Guidance literature:: With trifluoroacetic acid; In water; at 0 - 20 ℃; for 2h; enantioselective reaction;
DOI:10.3998/ark.5550190.p009.621

Reference yield:

: C₁₆H₂₁NO₄S

: 138079-74-0
(S)-2-(2-benzamidopropanoylthio)acetic acid

Guidance literature:: With trifluoroacetic acid; In water; at 0 - 20 ℃; for 2h;
DOI:10.3998/ark.5550190.p009.621

Reference yield:

: 98-88-4
benzoyl chloride

: 138079-74-0
(R)-2-(2-benzamidopropanoylthio)acetic acid

Guidance literature:: Multi-step reaction with 3 steps

1: water / 0 °C / pH 10

2: 4-methyl-morpholine; 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane-2,4,6-trioxide / ethyl acetate / -25 °C / Inert atmosphere

3: trifluoroacetic acid / water / 2 h / 0 - 20 °C

With 4-methyl-morpholine; 2,4,6-tripropyl-1,3,5,2,4,6-trioxatriphosphinane-2,4,6-trioxide; trifluoroacetic acid; In water; ethyl acetate; 1: |Schotten-Baumann Reaction;
DOI:10.3998/ark.5550190.p009.621