chempirical

Sodium barbital

C8H11N2NaO3CAS 144-02-5206.18 g/mol

Open in Covalent MOL file
ON−ONHONa+

Properties

Molecular formula
C8H11N2NaO3
Molar mass
206.18 g/mol
Exact mass
206.0667 Da
logP
1.46Crippen estimate
Polar surface area
82.3 Ų
H-bond donors / acceptors
2 / 1
Rotatable bonds
2

Identifiers

CAS number
144-02-5
SMILES
CCC1(CC)C(=O)[N-]C(=O)NC1=O.[Na+]
InChIKey
RTZOEZPIPKDVLT-UHFFFAOYSA-N
InChI
InChI=1S/C8H12N2O3.Na/c1-3-8(4-2)5(11)9-7(13)10-6(8)12;/h3-4H2,1-2H3,(H2,9,10,11,12,13);

Weigh it out

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

Names and synonyms

20 names · show all
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-, sodium salt (1:1)
  • Barbital soluble
  • Barbitone sodium
  • Diethylmalonylurea sodium
  • Embinal
  • Sodium barbitone
  • Sodium 5,5-diethylbarbiturate
  • Sodium diethylbarbiturate
  • Soluble barbital
  • Medinal
  • Veronal sodium
  • Sodium veronal
  • Nervoseton
  • Soprinal
  • Thyalone
  • Natrinal
  • Medina
  • Barbituric acid, 5,5-diethyl-, sodium salt
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5,5-diethyl-, monosodium salt
  • Barbital sodium

Work with Sodium barbital

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

Amobarbital sodium64-43-773 % similar Phenobarbital sodium57-30-757 % similar Pentobarbital sodium57-33-056 % similar Secobarbital sodium309-43-344 % similar Phenytoin sodium630-93-334 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook