Chloroacetic acid-1-13C

Base Information

• Chemical Name: Chloroacetic acid-1-13C
• CAS No.: 1681-52-3
• Molecular Formula: C₂H₃ClO₂
• Molecular Weight: 95.4866
• European Community (EC) Number: 687-234-2
• DSSTox Substance ID: DTXSID40583923
• Nikkaji Number: J2.049.911G
• Wikidata: Q82475533
• Mol file: 1681-52-3.mol

Synonyms:Chloroacetic acid-1-13C;1681-52-3;CHLOROACETIC-1-13C ACID;DTXSID40583923;Chloroacetic-1-13c acid,99 atom % 13c;Chloroacetic acid-1-13C, 99 atom % 13C;J-010431;J-011784

Chemical Property of Chloroacetic acid-1-13C

Chemical Property:

• Melting Point: 60-63 °C(lit.)
• Refractive Index: 1.437
• Boiling Point: 189 °C(lit.)
• Flash Point: 126℃
• PSA: 37.30000
• Density: 1.596 g/mL
• LogP: 0.30980
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 94.9855119
• Heavy Atom Count: 5
• Complexity: 42.9

Purity/Quality:

99% ^*data from raw suppliers

CHLOROACETIC ACID-1-13C 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T,N
• Statements: 23/24/25-34-50
• Safety Statements: 22-26-36/37/39-45-63-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(=O)O)Cl
• Isomeric SMILES: C([13C](=O)O)Cl

Technology Process of Chloroacetic acid-1-13C

There total 1 articles about Chloroacetic acid-1-13C 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:

→ chloroacetic acid-1-13C (1681-52-3)

Guidance literature:

<1-¹³C>Essigsaeure, Chlor;

DOI:10.1002/apmc.1976.050500104