Methohexital sodium

CAS Registry Number®

309-36-4

CAS Name

Methohexital sodium

Molecular Formula

C14H18N2O3.Na

Cite this Page

Methohexital sodium.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=309-36-4 (retrieved 2024-11-25) (CAS RN: 309-36-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H18N2O3.Na/c1-5-7-8-10(3)14(9-6-2)11(17)15-13(19)16(4)12(14)18;/h6,10H,2,5,9H2,1,3-4H3,(H,15,17,19);

InChIKey

InChIKey=ZNCHEYWRDOJPAW-UHFFFAOYSA-N

SMILES

C(C#CCC)(C)C1(CC=C)C(=O)N(C)C(=O)NC1=O.[Na]

Canonical SMILES

[Na].O=C1NC(=O)C(C(=O)N1C)(CC=C)C(C#CCC)C

Other Names for this Substance

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-(1-methyl-2-pentyn-1-yl)-5-(2-propen-1-yl)-, sodium salt (1:1)
  • Barbituric acid, 5-allyl-1-methyl-5-(1-methyl-2-pentynyl)-, sodium salt
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-methyl-5-(1-methyl-2-pentynyl)-5-(2-propenyl)-, sodium salt
  • Barbituric acid, 5-allyl-1-methyl-5-(1-methyl-2-pentynyl)-, sodium deriv.
  • Sodium methohexital

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Deleted or Replaced CAS Registry Numbers

22151-68-4, 32671-83-3, 33975-80-3, 60634-69-7

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