Thymidine 5'-monophosphate

Base Information

• Chemical Name: Thymidine 5'-monophosphate
• CAS No.: 14057-65-9
• Molecular Formula: C₁₀H₁₃N₂O₈P
• Molecular Weight: 320.196
• DSSTox Substance ID: DTXSID001310498
• Wikidata: Q743705
• Wikipedia: Thymidine_monophosphate
• Mol file: 14057-65-9.mol

Synonyms:Acid, Thymidylic;Acids, Thymidylic;Deoxythymidylate;DTMP;Monophosphate, Thymidine;Thymidine Monophosphate;Thymidylic Acid;Thymidylic Acids;TMP

Chemical Property of Thymidine 5'-monophosphate

Chemical Property:

• Storage Temp.: −20°C
• XLogP3: -3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 320.04095237
• Heavy Atom Count: 21
• Complexity: 518

Purity/Quality:

99% ^*data from raw suppliers

EMP-1 > 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)([O-])[O-])O
• Isomeric SMILES: CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)([O-])[O-])O

Technology Process of Thymidine 5'-monophosphate

There total 6 articles about Thymidine 5'-monophosphate 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: 99.5%

thymidine 5'-<3-hydroxy-2,2-di(ethoxycarbonyl)propyl-1>phosphate sodium salt → thymidine-5'-monophosphate dianion (14057-65-9)

Guidance literature:

With N-butylamine; In water; for 3h; Ambient temperature;

DOI:10.1016/0040-4020(95)00544-I

Reference yield:

thymidilyl(3'-5')thymidine (87367-14-4) → thymidine 3'-monophosphate + thymidine-5'-monophosphate dianion (14057-65-9) + thymidine (50-89-5,28854-96-8,3545-96-8,50-88-4)

Guidance literature:

With hydroxide; In water; at 80 ℃; pH=14; Kinetics;

DOI:10.1021/jo000323d

Reference yield:

deoxyadenosyl(5'-3')thymidine phosphate → thymidine-5'-monophosphate dianion (14057-65-9) + 2'-deoxy-D-adenosine (958-09-8,7005-15-4)

Guidance literature:

With 2-amino-2-hydroxymethyl-1,3-propanediol; sodium chloride; magnesium chloride; In water; glycerol; at 37 ℃; for 2h; Enzymatic reaction;

DOI:10.1002/ejoc.201300699

upstream raw materials:

thymidine 5'-p-nitrophenylphosphate

thymidilyl(3'-5')thymidine