1-methylbarbituric acid
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Product Description
Product
1-methylbarbituric acid
CAS
2565-47-1
Formula
C5H6N2O3
Synonym
N-METHYLBARBITURIC ACID; 1-methylbarbituric acid; 1-Methylpyrimidine-2,4,6(1H,3H,5H); 1-Methylpyrimidine-2,4,6(1H,3H,5H)-trione; 2,4,6(1H,3H,5H)-Pyrimidinetrione,1-methyl-; 3-METHYLBARBITURIC ACID; 1-methyl-1,3-diazinane-2,4,6-trione; 1-Methyl-2,4,6-Trihydroxy-Pyrimidine
Typical Product Specifications
Molecular weight
142.11
EINECS
219-894-0
SMILES
O=C1NC(=O)N(C)C(=O)C1
InChI
DCGGMHIZEAHUJL-UHFFFAOYSA-N
InChIKey
1S/C5H6N2O3/c1-7-4(9)2-3(8)6-5(7)10/h2H2,1H3,(H,6,8,10)
log P (octanol-water)
-0.85
Atmospheric OH Rate Constant
3.08E-12 cm3/molecule-sec
Water solubility
4.37E+05 mg/L
Henry's Law Constant
2.55E-13 atm-m3/mole
pKa Dissociation Constant
4.35
Vapor Pressure
9.45E-09 mm Hg
Class
1-methylbarbituric acid
Product Description
Product
1-methylbarbituric acid
CAS
2565-47-1
Formula
C5H6N2O3
Synonym
N-METHYLBARBITURIC ACID; 1-methylbarbituric acid; 1-Methylpyrimidine-2,4,6(1H,3H,5H); 1-Methylpyrimidine-2,4,6(1H,3H,5H)-trione; 2,4,6(1H,3H,5H)-Pyrimidinetrione,1-methyl-; 3-METHYLBARBITURIC ACID; 1-methyl-1,3-diazinane-2,4,6-trione; 1-Methyl-2,4,6-Trihydroxy-Pyrimidine
Typical Product Specifications
Molecular weight
142.11
EINECS
219-894-0
SMILES
O=C1NC(=O)N(C)C(=O)C1
InChI
DCGGMHIZEAHUJL-UHFFFAOYSA-N
InChIKey
1S/C5H6N2O3/c1-7-4(9)2-3(8)6-5(7)10/h2H2,1H3,(H,6,8,10)
log P (octanol-water)
-0.85
Atmospheric OH Rate Constant
3.08E-12 cm3/molecule-sec
Water solubility
4.37E+05 mg/L
Henry's Law Constant
2.55E-13 atm-m3/mole
pKa Dissociation Constant
4.35
Vapor Pressure
9.45E-09 mm Hg
Class
