Tazarotene

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Properties Simple | Detailed

Formula C21H21NO2S
IUPAC Name ethyl 6-[2-(4,4-dimethylthiochroman-6-yl)ethynyl]pyridine-3-carboxylate
Molecular Mass 351.462 g·mol−1
Heat of Formation 10.9 ± 16.7 kJ·mol−1
Dipole Moment 2.70 ± 1.08 D
Volume 423.43 Å 3
Surface Area 385.96 Å 2
HOMO Energy -8.34 ± 0.55 eV
LUMO Energy -1.34 ± eV
Point Group Symmetry C1
Synonyms
  • 3-pyridinecarboxylic acid, 6-((3,4-dihydro-4,4-dimethyl-2h-1-benzothiopyran-6-yl)ethynyl)-, ethyl ester
  • 6-[2-(4,4-dimethyl-6-thiochromanyl)ethynyl]-3-pyridinecarboxylic acid ethyl ester
  • 6-[2-(4,4-dimethylthiochroman-6-yl)ethynyl]nicotinic acid ethyl ester
  • agn 190168
  • agn-190168
  • avage
  • d01132
  • ethyl 6-((4,4-dimethylthiochroman-6-yl)ethynyl)nicotinate
  • suretin
  • tazarotene (jan/usan/inn)
  • tazorac
  • tazoral
  • zorac
CAS Number(s)
  • 118292-40-3
InChIKey OGQICQVSFDPSEI-UHFFFAOYSA-N
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