N-Tosyl-L-phenylglycine anion

Base Information

• Chemical Name: N-Tosyl-L-phenylglycine anion
• CAS No.: 60712-47-2
• Molecular Formula: C15H15 N O4 S
• Molecular Weight: 305.354
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID20976157
• Nikkaji Number: J2.516.933F
• Wikidata: Q82960944
• Mol file: 60712-47-2.mol

Synonyms:N-Tosyl-L-phenylglycine anion;DTXSID20976157;[(4-Methylbenzene-1-sulfonyl)amino](phenyl)acetate

Chemical Property of N-Tosyl-L-phenylglycine anion

Chemical Property:

• Vapor Pressure: 6.99E-11mmHg at 25°C
• Melting Point: 178-180°C
• Boiling Point: 501.6°C at 760 mmHg
• Flash Point: 257.2°C
• PSA: 91.85000
• LogP: 3.57090
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 304.06435410
• Heavy Atom Count: 21
• Complexity: 437

Purity/Quality:

98%Min ^*data from raw suppliers

2-{[(4-Methylphenyl)sulfonyl]amino}-2-phenylacetic acid >95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NC(C2=CC=CC=C2)C(=O)[O-]
• Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C2=CC=CC=C2)C(=O)[O-]

Technology Process of N-Tosyl-L-phenylglycine anion

There total 2 articles about N-Tosyl-L-phenylglycine anion 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: 66.0%

(R)-phenylglycine (875-74-1) + p-toluenesulfonyl chloride (98-59-9) → (R)-2-((4-methylphenyl)sulfonamido)-2-phenylacetic acid (60712-47-2)

Guidance literature:

With sodium hydroxide; In diethyl ether; at 20 ℃; for 16h;

DOI:10.1039/b505324b

Reference yield:

→ (R)-2-((4-methylphenyl)sulfonamido)-2-phenylacetic acid (60712-47-2)

Guidance literature:

/BRN= 3214965/;

DOI:10.1021/ja01546a039

Reference yield: 96.0%

bis((μ-chloro)chloro(pentamethylcyclopentadienyl)iridium) + (R)-2-((4-methylphenyl)sulfonamido)-2-phenylacetic acid (60712-47-2) → ((CH3)5C5)Ir(C2H(C6H5)O2NSO2C6H4CH3)

Guidance literature:

With K₂CO₃; In acetonitrile; N2-atmosphere; stirring (room temp., 6 h); elem. anal.;

DOI:10.1021/om00008a014

upstream raw materials:

(R)-phenylglycine

p-toluenesulfonyl chloride

Downstream raw materials:

N-(p-tolylsulfonyl)-D-α-phenylglycine chloride

N-toluenesulfonyl-N-methyl-D-phenylglycine

(R)-[Methyl-(toluene-4-sulfonyl)-amino]-phenyl-acetyl chloride

(R)-N-methoxy-N-methyl-2-phenyl-2-(tosylamino)acetamide

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