DL-Glutamic acid-2-13C

Base Information

• Chemical Name: DL-Glutamic acid-2-13C
• CAS No.: 108395-12-6
• Molecular Formula: C₅H₉NO₄
• Molecular Weight: 150.102
• DSSTox Substance ID: DTXSID30482294
• Mol file: 108395-12-6.mol

Synonyms:DL-Glutamic acid-2-13C;108395-12-6;2-amino(213C)pentanedioic acid;DTXSID30482294;DL-Glutamic acid-2-13C, 99 atom % 13C

Chemical Property of DL-Glutamic acid-2-13C

Chemical Property:

• Melting Point: 185?°C (dec.)(lit.)
• XLogP3: -3.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 148.05651260
• Heavy Atom Count: 10
• Complexity: 145

Purity/Quality:

99% atom 13C ^*data from raw suppliers

DL-GLUTAMIC ACID-2-13C 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC(=O)O)C(C(=O)O)N
• Isomeric SMILES: C(CC(=O)O)[13CH](C(=O)O)N

Technology Process of DL-Glutamic acid-2-13C

There total 10 articles about DL-Glutamic acid-2-13C 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: 82.0%

C12(13)CH20(2)H2N2O6 (1136765-26-8) → (2S,3S)-[2-(13)C;2,3-(2)H2]glutamic acid (1136765-27-9,108395-12-6)

Guidance literature:

C₁₂⁽¹³⁾CH₂₀⁽²⁾H₂N₂O₆; With hydrogenchloride; In water; Reflux;

With dowex 50Wx₈; optical yield given as %ee;

DOI:10.1016/j.tetlet.2009.01.062

Reference yield: 74.0%

C5(13)C5H13(2)H2(15)NO5 (1259016-71-1) → (2S,3S,4R)-[3,4-(2)H2;1,2,3,4,5-(13)C5;2-(15)N]glutamic acid (554428-56-7,108395-12-6,1202063-54-4,206983-94-0,95388-01-5)

Guidance literature:

C₅⁽¹³⁾C₅H₁₃⁽²⁾H₂⁽¹⁵⁾NO₅; With hydrogenchloride; In water; at 110 ℃; for 3h;

With water; sodium hydroxide; In dichloromethane; for 24h; pH=3; Cooling;

DOI:10.1021/ol1026766

Reference yield: 70.0%

C12(13)CH21(2)HN2O6 (1136765-17-7) → (2S,3R)-[2-13C;3-2H]glutamic acid (1136765-20-2,108395-12-6)

Guidance literature:

C₁₂⁽¹³⁾CH₂₁⁽²⁾HN₂O₆; With hydrogenchloride; In water; Reflux;

With dowex 50Wx₈; optical yield given as %ee;

DOI:10.1016/j.tetlet.2009.01.062

upstream raw materials:

<3-13C>-L-alanine

¹³C₅-¹⁵N₂-L-glutamine

(2S)-[2,3,4,5,6-⁽¹³⁾C₅;1-⁽¹⁵⁾N]N-tert-butoxycarbonyl-5-(tert-butyldimethylsilyloxymethyl)-1H-pyrrol-2(5H)-one

(2S,3S,4R)-[3,4-⁽²⁾H₂;2,3,4,5,6-⁽¹³⁾C₅;1-⁽¹⁵⁾N]N-tert-butoxycarbonyl-5-(tert-butyldimethylsilyloxymethyl)pyrrolidin-2-one

Downstream raw materials:

C₇⁽¹³⁾C₅H₁₄N₂O₅

C₉⁽¹³⁾C₅H₁₆N₂O₆

SAIL proline

(2S,3S,4R)-[1,2,3,4,5-13C5;2,5-13N2;3,4-2H2]glutamine