1,3-Diethyl-2-thiobarbituric acid

CAS Registry Number®

5217-47-0
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CAS Name

1,3-Diethyl-2-thiobarbituric acid

Molecular Formula

C8H12N2O2S

Molecular Mass

200.26

Cite this Page

1,3-Diethyl-2-thiobarbituric acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=5217-47-0 (retrieved 2024-04-28) (CAS RN: 5217-47-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    101-103 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H12N2O2S/c1-3-9-6(11)5-7(12)10(4-2)8(9)13/h3-5H2,1-2H3

InChIKey

InChIKey=SHBTUGJAKBRBBJ-UHFFFAOYSA-N

SMILES

C(C)N1C(=S)N(CC)C(=O)CC1=O

Canonical SMILES

O=C1N(C(=S)N(C(=O)C1)CC)CC

Other Names for this Substance

  • 4,6(1H,5H)-Pyrimidinedione, 1,3-diethyldihydro-2-thioxo-
  • Barbituric acid, 1,3-diethyl-2-thio-
  • 1,3-Diethyldihydro-2-thioxo-4,6(1H,5H)-pyrimidinedione
  • N,N′-Diethyl-2-thiobarbituric acid
  • 1,3-Diethyl-2-thiobarbituric acid

Deleted or Replaced CAS Registry Numbers

61732-60-3, 1190104-61-0, 2606824-87-5

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