1,3,5-Trimethylcyanuric Acid

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Properties Simple | Detailed

Formula C6H9N3O3
IUPAC Name 1,3,5-trimethyl-1,3,5-triazinane-2,4,6-trione
Molecular Mass 171.154 g·mol−1
Heat of Formation -555.3 ± 16.7 kJ·mol−1
Dipole Moment 0.04 ± 1.08 D
Volume 188.86 Å 3
Surface Area 185.99 Å 2
HOMO Energy -10.52 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,5-triazine-2,4,6(1h,3h,5h)-trione, 1,3,5-trimethyl-
  • 1,3,5-triazine-2,4,6(1h,3h,5h)-trione, 1,3,5-trimethyl- (9ci)
  • 1,3,5-trimethyl-2,4,6-trioxohexahydrotriazine
  • btb 10843
  • methyl isocyanate trimer
  • s-triazine-2,4,6(1h,3h,5h)-trione, 1,3,5-trimethyl-
  • s-triazine-2,4,6(1h,3h,5h)-trione, 1,3,5-trimethyl- (8ci)
  • sr-01000641172-1
CAS Number(s)
  • 827-16-7
InChIKey AHWDQDMGFXRVFB-UHFFFAOYSA-N
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