Tetrahydro-4-thioxo-1,3,5-triazine-1(2H)-butanoic acid

CAS Registry Number®

247109-16-6
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CAS Name

Tetrahydro-4-thioxo-1,3,5-triazine-1(2H)-butanoic acid

Molecular Formula

C7H13N3O2S

Molecular Mass

203.26

Cite this Page

Tetrahydro-4-thioxo-1,3,5-triazine-1(2H)-butanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=247109-16-6 (retrieved 2024-09-08) (CAS RN: 247109-16-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    163-167 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C7H13N3O2S/c11-6(12)2-1-3-10-4-8-7(13)9-5-10/h1-5H2,(H,11,12)(H2,8,9,13)

InChIKey

InChIKey=VBMQYMHDBZIRNJ-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)N1CNC(=S)NC1

Canonical SMILES

O=C(O)CCCN1CNC(=S)NC1

Other Names for this Substance

  • 1,3,5-Triazine-1(2H)-butanoic acid, tetrahydro-4-thioxo-
  • Tetrahydro-4-thioxo-1,3,5-triazine-1(2H)-butanoic acid