Bromacil

CAS Registry Number®

314-40-9

CAS Name

Bromacil

Molecular Formula

C9H13BrN2O2

Molecular Mass

261.12

Cite this Page

Bromacil.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=314-40-9 (retrieved 2024-11-21) (CAS RN: 314-40-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    157.5-160 °C

  • Density (1)

    1.55 g/cm³ @ Temp: 25 °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/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14)

InChIKey

InChIKey=CTSLUCNDVMMDHG-UHFFFAOYSA-N

SMILES

C(CC)(C)N1C(=O)C(Br)=C(C)NC1=O

Canonical SMILES

O=C1NC(=C(Br)C(=O)N1C(C)CC)C

Other Names for this Substance

  • 2,4(1H,3H)-Pyrimidinedione, 5-bromo-6-methyl-3-(1-methylpropyl)-
  • Uracil, 5-bromo-3-sec-butyl-6-methyl-
  • 5-Bromo-6-methyl-3-(1-methylpropyl)-2,4(1H,3H)-pyrimidinedione
  • Bromacil
  • 5-Bromo-3-sec-butyl-6-methyluracil

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Deleted or Replaced CAS Registry Numbers

154670-12-9

CAS INSIGHTSTM
Targeted protein degrader structure, illustration