6-Imino-5-ethyl-5-(1-methylbutyl) barbituric acid

Base Information

• Chemical Name: 6-Imino-5-ethyl-5-(1-methylbutyl) barbituric acid
• CAS No.: 330593-15-2
• Molecular Formula: C11H19N3O2
• Molecular Weight: 225.29
• UNII: 527K5G60J8
• ChEMBL ID: CHEMBL1900043
• Mol file: 330593-15-2.mol

Synonyms:330593-15-2;6-Imino-5-ethyl-5-(1-methylbutyl) barbituric acid;UNII-527K5G60J8;2,4(3H,5H)-Pyrimidinedione, 6-amino-5-ethyl-5-(1-methylbutyl)-;527K5G60J8;6-amino-5-ethyl-5-pentan-2-ylpyrimidine-2,4-dione;Pentobarbital impurity, 6-imino-5-ethyl-5-(1-methylbutyl) barbituric acid- [USP];5-Ethyl-6-imino-5-(1-methyl-butyl)-dihydro-pyrimidine-2,4-dione;SMR000221819;CBDivE_001407;MLS000332547;CHEMBL1900043;CLQPRFRZKLHZSC-UHFFFAOYSA-N;HMS2594P08;HMS3380L15;PENTOBARBITAL IMPURITY B [EP IMPURITY];PENTOBARBITAL SODIUM IMPURITY B [EP IMPURITY];5-Ethyl-6-imino-5-(1-methylbutyl)dihydro-2,4(1H,3H)-pyrimidinedione #;PENTOBARBITAL IMPURITY, 6-IMINO-5-ETHYL-5-(1-METHYLBUTYL) BARBITURIC ACID- [USP IMPURITY]

Chemical Property of 6-Imino-5-ethyl-5-(1-methylbutyl) barbituric acid

Chemical Property:

• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 225.147726857
• Heavy Atom Count: 16
• Complexity: 338

Purity/Quality:

98% ^*data from raw suppliers

6-Amino-5-ethyl-5-(1-methylbutyl)-2,4(3H,5H)-pyrimidinedione ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCC(C)C1(C(=NC(=O)NC1=O)N)CC
• Uses: 6-Amino-5-ethyl-5-(1-methylbutyl)-2,4(3H,5H)-pyrimidinedione is an impurity of Pentobarbital (P276000), an sedative and hypnotic.

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