CHLOROACETYL-L-VALINE

Base Information

• Chemical Name: CHLOROACETYL-L-VALINE
• CAS No.: 2279-16-5
• Molecular Formula: C₇H₁₂ClNO₃
• Molecular Weight: 193.63
• Hs Code.: 2924199090
• European Community (EC) Number: 623-225-1
• Nikkaji Number: J208.174A
• Mol file: 2279-16-5.mol

Synonyms:L-Valine,N-(chloroacetyl)- (9CI); Valine, N-(chloroacetyl)-, L- (8CI);N-Chloroacetyl-L-valine; NSC 97928

Chemical Property of CHLOROACETYL-L-VALINE

Chemical Property:

• Vapor Pressure: 2.54E-07mmHg at 25°C
• Melting Point: 115 °C
• Boiling Point: 394.4°Cat760mmHg
• Flash Point: 192.3°C
• PSA: 66.40000
• Density: 1.235g/cm³
• LogP: 0.84150
• Storage Temp.: −20°C
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 193.0505709
• Heavy Atom Count: 12
• Complexity: 182

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-Chloroacetyl-L-valine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)C(C(=O)O)NC(=O)CCl
• Isomeric SMILES: CC(C)[C@@H](C(=O)O)NC(=O)CCl

Technology Process of CHLOROACETYL-L-VALINE

There total 4 articles about CHLOROACETYL-L-VALINE 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:

L-glycyl-L-valine (1963-21-9,6491-59-4) → N-chloroacetyl-L-valine (2279-16-5)

Guidance literature:

With nitrosylchloride; In formic acid;

Reference yield:

L-valine (72-18-4,25609-85-2,7004-03-7,921-10-8) + chloroacetic acid (79-11-8) → N-chloroacetyl-L-valine (2279-16-5)

Guidance literature:

In acetonitrile; at 20 ℃; for 48h;

DOI:10.1023/B:RUCB.0000011878.52263.c4

Reference yield:

L-valine (72-18-4,25609-85-2,7004-03-7,921-10-8) → N-chloroacetyl-L-valine (2279-16-5)

Guidance literature:

upstream raw materials:

L-valine

L-glycyl-L-valine

chloroacetic acid

D,L-valine

Downstream raw materials:

C₇H₁₁NO₆P^(3-)*3Na⁽¹⁺⁾

Refernces