FUMARIC-2,3-D2 ACID

Base Information

• Chemical Name: FUMARIC-2,3-D2 ACID
• CAS No.: 24461-32-3
• Molecular Formula: C4H2 D2 O4
• Molecular Weight: 118.057
• Mol file: 24461-32-3.mol

Synonyms:2-Butenedioic-2,3-d2acid, (E)-; Fumaric-2,3-d2 acid (6CI,8CI); Fumaric-d2 acid (7CI)

Chemical Property of FUMARIC-2,3-D2 ACID

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 299-300oC (subl.)(lit.)
• Boiling Point: 355.482°C at 760 mmHg
• Flash Point: 182.981°C
• PSA: 74.60000
• Density: 1.525g/cm³
• LogP: -0.28820

Purity/Quality:

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

FumaricAcid-d2 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38-41-36
• Safety Statements: 26-36

MSDS Files:

Useful:

• Uses: Fumaric Acid-d2 is the isotope labelled analog of Fumaric Acid. Fumaric acid is a compound that occurs in many plants. It is essential to vegetable and tissue respiration and also used as an antioxidant. Fumaric acid is also a metabolite of Dimethyl Fumarate (D464965), a compound used as a treatment for the relapsing forms of multiple sclerosis and psoriasis.

Technology Process of FUMARIC-2,3-D2 ACID

There total 2 articles about FUMARIC-2,3-D2 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: 90.0%

dimethyl fumaric(2,3-2H2) acid ester (23057-98-9) → 2,3-[2H2]-fumaric acid (24461-32-3)

Guidance literature:

With sodium hydroxide; In water; for 72h; Ambient temperature;

Reference yield: 89.0%

trisodium tris(3-sulfophenyl)phosphine (63995-70-0) + Acetylenedicarboxylic acid (142-45-0) → 2,3-[2H2]-fumaric acid (24461-32-3) + tris(natrium-m-sulfonatophenyl)phosphanoxid (98511-67-2)

Guidance literature:

In water-d2; for 5h; Ambient temperature;

DOI:10.1016/S0040-4020(01)96009-0

Reference yield: 99.0%

2,3-[2H2]-fumaric acid (24461-32-3) + dibenzylamine (103-49-1) → N1,N1,N4,N4-tetrabenzylfumaramide-d2

Guidance literature:

2,3-[²H₂]-fumaric acid; dibenzylamine; With dmap; In dichloromethane; at 0 ℃; for 0.25h; Inert atmosphere;

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; at 25 ℃; for 48h; Inert atmosphere;

DOI:10.1021/jacs.0c04477

upstream raw materials:

dimethyl fumaric(2,3-²H₂) acid ester

trisodium tris(3-sulfophenyl)phosphine

Acetylenedicarboxylic acid

Downstream raw materials:

dimethyl fumaric(2,3-²H₂) acid ester

Refernces

• 1、 Barclay, Fiona,Chrystal, Ewan,Gani, David. "Synthesis of (2S)-O-phosphohomoserine and its C-2 deuteriated and C-3 chirally deuteriated isotopomers: Probes for the pyridoxal phosphate-dependent threonine synthase reaction". . p. 683 - 689. Retrieved 2007/10/03.
• 2、 Lee, Kang-Man,Ramalingam, Kondareddiar,Son, Jong-Keun,Woodard, Ronald W.. "A Highly Efficient and Large-Scale Synthesis of (2S,3S)-- and (2S,3R)-Aspartic Acids via an Immobilized Aspartase-Containing Microbial Cell System". . p. 3195 - 3198. Retrieved 2007/10/02.