2,3-Dihydro-6-methyl-2-thioxo-(1H,8H)-pteridine-4,7-dione

Base Information

• Chemical Name: 2,3-Dihydro-6-methyl-2-thioxo-(1H,8H)-pteridine-4,7-dione
• CAS No.: 94088-97-8
• Molecular Formula: C7H6 N4 O2 S
• Molecular Weight: 210.216
• Hs Code.: 2933990090
• European Community (EC) Number: 302-099-9
• NSC Number: 67305
• UNII: R7RW14NC4T
• DSSTox Substance ID: DTXSID30240497
• Nikkaji Number: J288.576J
• ChEMBL ID: CHEMBL1712631
• Mol file: 94088-97-8.mol

Synonyms:94088-97-8;2,3-Dihydro-6-methyl-2-thioxo-(1H,8H)-pteridine-4,7-dione;R7RW14NC4T;MLS002693593;EINECS 302-099-9;NSC 67305;NSC-67305;2,3-Dihydro-6-methyl-2-thioxo-4,7(1H,8H)-pteridinedione;NSC67305;UNII-R7RW14NC4T;CHEMBL1712631;DTXSID30240497;HMS3085L03;AKOS024332379;SMR001559540;4,7(1H,8H)-PTERIDINEDIONE, 2,3-DIHYDRO-6-METHYL-2-THIOXO-

Chemical Property of 2,3-Dihydro-6-methyl-2-thioxo-(1H,8H)-pteridine-4,7-dione

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 126.49000
• Density: 1.92g/cm³
• LogP: -0.02260
• XLogP3: -1.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 210.02114662
• Heavy Atom Count: 14
• Complexity: 423

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC2=C(NC1=O)NC(=S)NC2=O

Technology Process of 2,3-Dihydro-6-methyl-2-thioxo-(1H,8H)-pteridine-4,7-dione

There total 1 articles about 2,3-Dihydro-6-methyl-2-thioxo-(1H,8H)-pteridine-4,7-dione 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:

5,6-diamino-2-thioxo-2,3-dihydropyrimidin-4(1H)-one (1004-76-8) + 2-oxo-propionic acid (127-17-3) → 6-methyl-2-thioxo-2,3-dihydro-1H,8H-pteridine-4,7-dione (94088-97-8)

Guidance literature:

With acetic acid;

DOI:10.1021/ja01164a058

upstream raw materials:

5,6-diamino-2-thioxo-2,3-dihydropyrimidin-4(1H)-one

2-oxo-propionic acid