Urea-13C,15N2

Base Information

• Chemical Name: Urea-13C,15N2
• CAS No.: 58069-83-3
• Molecular Formula: CH4N2O
• Molecular Weight: 63.0312
• European Community (EC) Number: 622-678-2
• DSSTox Substance ID: DTXSID80973642
• Wikidata: Q82957618
• Mol file: 58069-83-3.mol

Synonyms:Urea-13C,15N2;58069-83-3;78405-35-3;Urea-13C,-15N2;UREA (13C, 15N2);Urea-13C-15N2;bis(15N)(azanyl)(113C)methanone;Carbamide-13C;Urepearl-13C;Urea(13c,15n2);DTXSID80973642;XSQUKJJJFZCRTK-VMIGTVKRSA-N;HY-Y0271S2;STR11788;MFCD00145506;AKOS015913111;Urea (13C, 99%, 15N2;(~13~C,~15~N_2_)Carbamimidic acid;((1)(3)C,(1)?N?)UREA;CS-0542124;Urea-13C,15N2, 99 atom % 13C, 98 atom % 15N

Chemical Property of Urea-13C,15N2

Chemical Property:

• Melting Point: 132-135 °C(lit.)
• Refractive Index: 1.468
• PSA: 69.11000
• Density: 1.212g/cm³
• LogP: 0.42440
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: -1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 63.02978738
• Heavy Atom Count: 4
• Complexity: 29

Purity/Quality:

99% ^*data from raw suppliers

Urea-13C,15N2 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 36/37/38-40
• Safety Statements: 22-26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(=O)(N)N
• Isomeric SMILES: [13C](=O)([15NH2])[15NH2]

Technology Process of Urea-13C,15N2

There total 2 articles about Urea-13C,15N2 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:

(13)C4H8(15)N4O4 → <13C15N2>urea (58069-83-3,78405-35-3) + (13)C2H4O4

Guidance literature:

With Proteus sp. glutamate dehydrogenase; recombinant full-length histidine-tagged allantoate amidohydrolase; water; α-ketoglutarate; NADPH; manganese(ll) chloride; pH=8.5; aq. buffer; Enzymatic reaction;

DOI:10.1021/cb900248n

Reference yield:

→ <13C15N2>urea (58069-83-3,78405-35-3)

Guidance literature:

13CO, 15NH3, S;

DOI:10.1002/jlcr.2590110203

Reference yield: 87.6%

<13C15N2>urea (58069-83-3,78405-35-3) → (13)C2H6N2(15)N2O2

Guidance literature:

With sulfuric acid; hydrazine hydrate; at 120 ℃; for 7h; Temperature;

Downstream raw materials:

uracil-<1,3-15N2-2-13C>

5,6-dihydrouracil-[1,3-15N2-2-13C]

carbon dioxide

Refernces