- InChI
- InChI=1S/C13H14N2O3/c1-3-13(9-7-5-4-6-8-9)10(16)14-12(18)15(2)11(13)17/h4-8H,3H2,1-2H3,(H,14,16,18)
- InChI Key
- ALARQZQTBTVLJV-UHFFFAOYSA-N
- Formula
- C13H14N2O3
- SMILES
-
CCC1(c2ccccc2)C(=O)NC(=O)N(C)C
1=O - Molecular Weight1
- 246.26
- CAS
- 115-38-8
- Other Names
-
- 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-methyl-5-phenyl-
- Barbituric acid, 5-ethyl-1-methyl-5-phenyl-
- Enfenemal
- Enphenemal
- Isonal
- Isonal (Roussel)
- Mebaral
- Mephobarbitone
- Mephytal
- Methyl phenobarbitone
- Methyl-calminal
- Methylphenobarbital
- Metylfenemal
- Metyna
- Morbusan
- N-Methyl-5-phenyl-5-ethylbarbituric acid
- N-Methylethylphenylbarbituric acid
- N-Methylphenobarbital
- Phemetone
- Phemiton
- Phemitone
- Prominal
- 1-Methylphenobarbital
- N-Ethylmethylphenylbarbituric acid
- 5-Ethyl-N-methyl-5-phenylbarbituric acid
- 5-Ethyl-1-methyl-5-phenylbarbituric acid
- 5-Ethyl-5-phenyl-N-methyl-bartituric acid
- Meberal
- Menta-bal
- 1-Methyl-5-ethyl-5-phenylbarbituric acid
- N-Methylphenolbarbitol
- Methylphenylbarbituric acid
- N-Methyl-5-phenyl-5-ethylbarbital
- 1-Methyl-5-phenyl-5-ethylbarbituric acid
- 5-Phenyl-5-ethyl-3-methylbarbituric acid
- 5-Ethyl-1-methyl-5-phenyl-2,4,6(1H,3H,5H)-pyrimidinetrione
- 1-Methyl-5-ethyl-5-phenyl-pyrimidine-2,4,6-trione
- Hexahydropyrimidine-2,4,6-trione,1-methyl-5-ethyl-5-phenyl-
- Phenobarbital, mono-methyl
- (.+/-.)-Mephobarbital
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| log10WS | -2.00 | Crippen Calculated Property | |
| logPoct/wat | 1.043 | Crippen Calculated Property | |
| McVol | 184.080 | ml/mol | McGowan Calculated Property |
| Inp | [1869.00; 1898.00] |
|
|
| Inp | 1883.00 | NIST | |
| Inp | 1888.00 | NIST | |
| Inp | 1875.00 | NIST | |
| Inp | 1890.00 | NIST | |
| Inp | 1885.00 | NIST | |
| Inp | 1890.00 | NIST | |
| Inp | 1890.00 | NIST | |
| Inp | 1890.00 | NIST | |
| Inp | 1895.00 | NIST | |
| Inp | 1895.00 | NIST | |
| Inp | 1880.00 | NIST | |
| Inp | 1875.00 | NIST | |
| Inp | 1898.00 | NIST | |
| Inp | 1869.00 | NIST | |
| Inp | 1869.00 | NIST | |
| Inp | 1874.00 | NIST | |
| Inp | 1876.00 | NIST | |
| Inp | 1885.00 | NIST | |
| Inp | 1895.00 | NIST | |
| Inp | 1885.00 | NIST | |
| Inp | 1885.00 | NIST | |
| Inp | 1891.00 | NIST | |
| Inp | 1874.00 | NIST | |
| Inp | 1885.00 | NIST | |
| Inp | 1883.00 | NIST | |
| Inp | 1890.00 | NIST | |
| Inp | 1891.00 | NIST | |
| Inp | 1895.00 | NIST |
Similar Compounds
Find more compounds similar to Mephobarbital.
Sources
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