Ethane-13C2

Base Information

• Chemical Name: Ethane-13C2
• CAS No.: 52026-74-1
• Molecular Formula: C2H6
• Molecular Weight: 32.0476
• European Community (EC) Number: 685-776-4
• DSSTox Substance ID: DTXSID10482156
• Nikkaji Number: J810.705J
• Wikidata: Q82318145
• Mol file: 52026-74-1.mol

Synonyms:Ethane-13C2;(1,2-13C2)ethane;52026-74-1;DTXSID10482156;Ethane-13C2, 99 atom % 13C;AKOS015913327

Chemical Property of Ethane-13C2

Chemical Property:

• Vapor Pressure: 37.95 atm ( 21.1 °C)
• Melting Point: −172 °C(lit.)
• Boiling Point: −88 °C(lit.)
• PSA: 0.00000
• LogP: 1.02620
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 32.053659862
• Heavy Atom Count: 2
• Complexity: 0

Purity/Quality:

ETHANE-13C2 95.00% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F+
• Statements: 12
• Safety Statements: 9-16-33-38

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC
• Isomeric SMILES: [13CH3][13CH3]

Technology Process of Ethane-13C2

There total 11 articles about Ethane-13C2 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:

[13C]Carbon monoxide (1641-69-6) → methane (6532-48-5) + methane (34557-54-5,27936-85-2) + ethane (74-84-0) + ethene (74-85-1) + ethane-13C2 (52026-74-1) + [13C2]ethene (51915-19-6)

Guidance literature:

With sodium dithionite; Phosphocreatine; carbide containing iron-molybdenum co-factor of molybdenum nitrogenase; His-tagged Fe protein; ATP; magnesium chloride; creatine phosphokinase; In aq. buffer; at 30 ℃; for 3h; pH=8;

DOI:10.1021/ja401698d

Reference yield:

methane (6532-48-5) + propane (74-98-6) → ethane-13C1 (6145-17-1) + ethane (74-84-0) + ethane-13C2 (52026-74-1)

Guidance literature:

With tnatalum hydride on silica; at 250 ℃; Further Variations:; time dependence; Product distribution;

DOI:10.1002/anie.200460982

Reference yield:

ethanol-1-13C (14742-23-5) → carbon monoxide-13C-18O (35907-63-2) + carbon dioxide-13C-18O1 (20201-82-5) + methane (6532-48-5) + ethane-13C1 (6145-17-1) + methane (34557-54-5,27936-85-2) + ethane (74-84-0) + ethene (74-85-1) + ethane-13C2 (52026-74-1) + [13C2]ethene (51915-19-6) + mono-[13C]-ethylene (6145-18-2) + carbon dioxide (124-38-9,18923-20-1) + carbon monoxide (55125-78-5) + carbon dioxide (1111-72-4) + [13C]Carbon monoxide (1641-69-6) + carbon dioxide (2537-69-1) + CO(18)O (18983-82-9) + carbon dioxide (2684-00-6)

Guidance literature:

With ¹⁸O-labeled water; at 350 ℃; Reagent/catalyst; Inert atmosphere;

DOI:10.1002/anie.201604388

upstream raw materials:

[13C₂]ethene

methane

ethane

propane

Refernces

• 1、 Soulivong, Daravong,Coperet, Christophe,Thivolle-Cazat, Jean,Basset, Jean-Marie,Maunders, Barry M.,Pardy, Richard B. A.,Sunley, Glenn J.. "Cross-metathesis of propane and methane: A catalytic reaction of C-C bond cleavage of a higher alkane by methane". . p. 5366 - 5369. Retrieved 2004.
• 2、 Thevenon, Arnaud,Rosas-Hernández, Alonso,Peters, Jonas C.,Agapie, Theodor. "In-Situ Nanostructuring and Stabilization of Polycrystalline Copper by an Organic Salt Additive Promotes Electrocatalytic CO2 Reduction to Ethylene". supporting information. p. 16952 - 16958. Retrieved 2019/11/21.
• 3、 Wiig, Jared A.,Lee, Chi Chung,Hu, Yilin,Ribbe, Markus W.. "Tracing the interstitial carbide of the nitrogenase cofactor during substrate turnover". supporting information. p. 4982 - 4983. Retrieved 2013/06/04.