Phenobarbital sodium

C₁₂H₁₁N₂NaO₃CAS 57-30-7254.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₂H₁₁N₂NaO₃
Molar mass: 254.22 g/mol
Exact mass: 254.0667 Da
logP: 2.00Crippen estimate
Polar surface area: 82.3 Å²
H-bond donors / acceptors: 2 / 1
Rotatable bonds: 2

Identifiers

CAS number

57-30-7

SMILES

CCC1(c2ccccc2)C(=O)[N-]C(=O)NC1=O.[Na+]

InChIKey

ZNCBYKFHRGFCSH-UHFFFAOYSA-N

InChI

InChI=1S/C12H12N2O3.Na/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16;/h3-7H,2H2,1H3,(H2,13,14,15,16,17);

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

22 names · show all

2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-phenyl-, sodium salt (1:1)
Barbituric acid, 5-ethyl-5-phenyl-, sodium salt
2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-phenyl-, monosodium salt
5-Ethyl-5-phenylbarbituric acid sodium
Gardenal sodium
Luminal sodium
Phenemalum
Phenobal sodium
Phenobarbitone sodium
Sodium 5-ethyl-5-phenylbarbiturate
Sodium luminal
Sodium phenobarbital
Sodium phenobarbitone
Sodium phenylethylbarbiturate
Soluble phenobarbital
Soluble phenobarbitone
Sol phenobarbital
Sol phenobarbitone
Sodium phenylethylmalonylurea
Phenobal
Sodium ethylphenylbarbiturate
Linasen

Work with Phenobarbital sodium

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Sodium barbital144-02-557 % similar Phenytoin sodium630-93-351 % similar Amobarbital sodium64-43-747 % similar Pentobarbital sodium57-33-046 % similar 1,3-Diethyl 2-ethyl-2-phenylpropanedioate76-67-541 % similar Phenobarbital50-06-639 % similar Secobarbital sodium309-43-338 % similar Phenylethylmalonamide7206-76-038 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Nalidixic acid sodium salt3374-05-8

Elsewhere

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