Butobarbital

CAS Registry Number®

77-28-1
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CAS Name

Butobarbital

Molecular Formula

C10H16N2O3

Molecular Mass

212.25

Cite this Page

Butobarbital.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=77-28-1 (retrieved 2024-04-29) (CAS RN: 77-28-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    128.5 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C10H16N2O3/c1-3-5-6-10(4-2)7(13)11-9(15)12-8(10)14/h3-6H2,1-2H3,(H2,11,12,13,14,15)

InChIKey

InChIKey=STDBAQMTJLUMFW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-butyl-5-ethyl-
  • Butethal
  • Barbituric acid, 5-butyl-5-ethyl-
  • 5-Butyl-5-ethyl-2,4,6(1H,3H,5H)-pyrimidinetrione
  • Butobarbital

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