Terbacil

CAS Registry Number®

5902-51-2
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CAS Name

Terbacil

Molecular Formula

C9H13ClN2O2

Molecular Mass

216.66

Cite this Page

Terbacil.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?ref=5902-51-2 (retrieved 2024-05-03) (CAS RN: 5902-51-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    175-177 °C

  • Density (1)

    1.34 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/C9H13ClN2O2/c1-5-6(10)7(13)12(8(14)11-5)9(2,3)4/h1-4H3,(H,11,14)

InChIKey

InChIKey=NBQCNZYJJMBDKY-UHFFFAOYSA-N

SMILES

C(C)(C)(C)N1C(=O)C(Cl)=C(C)NC1=O

Canonical SMILES

O=C1NC(=C(Cl)C(=O)N1C(C)(C)C)C

Other Names for this Substance

  • 2,4(1H,3H)-Pyrimidinedione, 5-chloro-3-(1,1-dimethylethyl)-6-methyl-
  • Uracil, 3-tert-butyl-5-chloro-6-methyl-
  • 5-Chloro-3-(1,1-dimethylethyl)-6-methyl-2,4(1H,3H)-pyrimidinedione
  • 3-tert-Butyl-5-chloro-6-methyluracil
  • 5-Chloro-3-tert-butyl-6-methyluracil

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