Talbutal

CAS Registry Number®

115-44-6
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CAS Name

Talbutal

Molecular Formula

C11H16N2O3

Molecular Mass

224.26

Cite this Page

Talbutal.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=115-44-6 (retrieved 2024-04-20) (CAS RN: 115-44-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    108-110 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C11H16N2O3/c1-4-6-11(7(3)5-2)8(14)12-10(16)13-9(11)15/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16)

InChIKey

InChIKey=BJVVMKUXKQHWJK-UHFFFAOYSA-N

SMILES

C(CC)(C)C1(CC=C)C(=O)NC(=O)NC1=O

Canonical SMILES

O=C1NC(=O)C(C(=O)N1)(CC=C)C(C)CC

Other Names for this Substance

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylpropyl)-5-(2-propen-1-yl)-
  • Barbituric acid, 5-allyl-5-sec-butyl-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-methylpropyl)-5-(2-propenyl)-
  • 5-(1-Methylpropyl)-5-(2-propen-1-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione
  • 5-Allyl-5-sec-butylbarbituric acid

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Deleted or Replaced CAS Registry Numbers

97233-46-0

CAS INSIGHTSTM
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