(R)-methyl 3-(4,6-dihydroxypyrimidin-5-yl)butanoate

Base Information

• Chemical Name: (R)-methyl 3-(4,6-dihydroxypyrimidin-5-yl)butanoate
• CAS No.: 1245646-90-5
• Molecular Formula: C9H12N2O4
• Molecular Weight: 212.2
• DSSTox Substance ID: DTXSID00705104
• Wikidata: Q82637806
• Mol file: 1245646-90-5.mol

Synonyms:(R)-methyl 3-(4,6-dihydroxypyrimidin-5-yl)butanoate;1245646-90-5;SCHEMBL15391259;DTXSID00705104;methyl (R)-3-(4,6-dihydroxypyrimidin-5-yl)butanoate;Methyl (3R)-3-(4-hydroxy-6-oxo-1,6-dihydropyrimidin-5-yl)butanoate

Chemical Property of (R)-methyl 3-(4,6-dihydroxypyrimidin-5-yl)butanoate

Chemical Property:

• PSA: 92.54000
• LogP: 0.55440
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 212.07970687
• Heavy Atom Count: 15
• Complexity: 346

Purity/Quality:

99% ^*data from raw suppliers

(R)-METHYL 3-(4,6-DIHYDROXYPYRIMIDIN-5-YL)BUTANOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC(=O)OC)C1=C(N=CNC1=O)O
• Isomeric SMILES: C[C@H](CC(=O)OC)C1=C(N=CNC1=O)O