2-Desamino-2-hydroxy trimethoprim

Base Information

• Chemical Name: 2-Desamino-2-hydroxy trimethoprim
• CAS No.: 60729-91-1
• Molecular Formula: C14H17N3O4
• Molecular Weight: 291.30248
• Hs Code.: 2933599550
• European Community (EC) Number: 641-680-4
• UNII: 376E44QHJS
• Nikkaji Number: J331.231C
• Wikidata: Q27256640
• Mol file: 60729-91-1.mol

Synonyms:60729-91-1;2-Desamino-2-hydroxy trimethoprim;4-Amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-ol;6-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-1H-pyrimidin-2-one;376E44QHJS;4-Amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2(1H)-pyrimidinone;2(1H)-Pyrimidinone, 6-amino-5-((3,4,5-trimethoxyphenyl)methyl)-;Trimethoprim Related Compound A (25 mg) (4-amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2-ol) (AS);6-Amino-5-(3,4,5-trimethoxybenzyl)pyrimidin-2(1H)-one;UNII-376E44QHJS;Trimethoprim impurity E [EP];TRIMETHOPRIM IMPURITY E [EP IMPURITY];Q27256640;6-amino-5-[(3,4,5-trimethoxyphenyl)methyl]-1,2-dihydropyrimidin-2-one

Chemical Property of 2-Desamino-2-hydroxy trimethoprim

Chemical Property:

• PKA: 8.77±0.10(Predicted)
• Density: 1.31±0.1 g/cm3(Predicted)
• Storage Temp.: Hygroscopic, -20°C Freezer, Under inert atmosphere
• Solubility.: DMSO (Slightly), Methanol (Slightly, Heated)
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 291.12190603
• Heavy Atom Count: 21
• Complexity: 436

Purity/Quality:

99%, ^*data from raw suppliers

4-Amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2(1H)-pyrimidinone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC(=CC(=C1OC)OC)CC2=C(NC(=O)N=C2)N
• Uses: 6-Amino-5-[(3,4,5-trimethoxyphenyl)methyl]-2(1H)-pyrimidinone, is an impurity of Trimethoprim (T795615), an antibacterial agent.