2,2-Dideuteriododecanoic acid

Base Information

Chemical Name:2,2-Dideuteriododecanoic acid
CAS No.:64118-39-4
Molecular Formula:C₁₂H₂₄O₂
Molecular Weight:202.305
Hs Code.:
DSSTox Substance ID:DTXSID70481362
Wikidata:Q82316722
Mol file:64118-39-4.mol

Synonyms:64118-39-4;2,2-dideuteriododecanoic acid;DODECANOIC-2,2-D2 ACID;Lauric acid-d2;Lauric-2,2-d2 acid;dodecanoic acid-d2;DTXSID70481362;HY-Y0366S2;Lauric-2,2-d2 acid, 98 atom % D;CS-0203921;D98827

Suppliers and Price of 2,2-Dideuteriododecanoic 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

American Custom Chemicals Corporation
LAURIC-2,2-D2 ACID 95.00%
1G
$ 873.18

AK Scientific
2,2-Dideuteriododecanoicacid
500mg
$ 478.00

AK Scientific
2,2-Dideuteriododecanoicacid
250mg
$ 313.00

AK Scientific
2,2-Dideuteriododecanoicacid
50mg
$ 147.00

Total 6 raw suppliers

Chemical Property of 2,2-Dideuteriododecanoic acid

Chemical Property:

Melting Point:44-46 °C(lit.)
Boiling Point:225 °C100 mm Hg(lit.)
Flash Point:113 °C
PSA：37.30000
LogP:3.99190
XLogP3:4.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:10
Exact Mass:202.190183496
Heavy Atom Count:14
Complexity:132

Purity/Quality:

98% atom D ^*data from raw suppliers

LAURIC-2,2-D2 ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-28

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CCCCCCCCCCCC(=O)O
Isomeric SMILES:[2H]C([2H])(CCCCCCCCCC)C(=O)O
Uses Dodecanoic-2,2-d2 Acid (CAS# 64118-39-4) is a useful isotopically labeled research compound.

Technology Process of 2,2-Dideuteriododecanoic acid

There total 5 articles about 2,2-Dideuteriododecanoic 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:

: 129355-47-1
2,2-Dideuteriododecyl aldehyde

: 64118-39-4
2,2-di-2H-lauric acid

Guidance literature:: With potassium permanganate; sulfuric acid; In water; for 2h;
DOI:10.1021/j100188a058

Reference yield:

: 112-54-9
Dodecanal

: 64118-39-4
2,2-di-2H-lauric acid

Guidance literature:: Multi-step reaction with 2 steps

1: D₂O, pyridine / 16 h / Heating

2: KMnO₄, 95.5 percent H₂SO₄ / H₂O / 2 h

With pyridine; potassium permanganate; sulfuric acid; water-d2; In water;
DOI:10.1021/j100188a058