Nealbarbital

CAS Registry Number®

561-83-1

CAS Name

Nealbarbital

Molecular Formula

C12H18N2O3

Molecular Mass

238.28

Cite this Page

Nealbarbital.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=561-83-1 (retrieved 2024-11-22) (CAS RN: 561-83-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    156 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C12H18N2O3/c1-5-6-12(7-11(2,3)4)8(15)13-10(17)14-9(12)16/h5H,1,6-7H2,2-4H3,(H2,13,14,15,16,17)

InChIKey

InChIKey=YHKPTICJRUESOY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2,2-dimethylpropyl)-5-(2-propen-1-yl)-
  • Barbituric acid, 5-allyl-5-neopentyl-
  • 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(2,2-dimethylpropyl)-5-(2-propenyl)-
  • 5-(2,2-Dimethylpropyl)-5-(2-propen-1-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione
  • 5055

View All

Deleted or Replaced CAS Registry Numbers

38211-35-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration