(±)-Pentobarbital
CAS Registry Number®
76-74-4
CAS Name
(±)-PentobarbitalMolecular Formula
C11H18N2O3Molecular Mass
226.27Cite this Page
(±)-Pentobarbital. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?ref=76-74-4 (retrieved ) (CAS RN: 76-74-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Melting Point (1)
130 °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/C11H18N2O3/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)
InChIKey
InChIKey=WEXRUCMBJFQVBZ-UHFFFAOYSA-N
SMILES
C(CCC)(C)C1(CC)C(=O)NC(=O)NC1=O
Canonical SMILES
O=C1NC(=O)C(C(=O)N1)(CC)C(C)CCC
Other Names for this Substance
- 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-5-(1-methylbutyl)-
- Barbituric acid, 5-ethyl-5-(1-methylbutyl)-
- 5-Ethyl-5-(1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
- Ethaminal
- 5-Ethyl-5-(1-methylbutyl)barbituric acid
Deleted or Replaced CAS Registry Numbers
5992-37-0