3-Chloro-4-(Dimethylamino)-2H-Thieno[2,3-H]Chromen-2-One

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Properties Simple | Detailed

Formula C13H10ClNO2S
IUPAC Name 3-chloro-4-(dimethylamino)thieno[2,3-h]chromen-2-one
Molecular Mass 279.742 g·mol−1
Heat of Formation -105.1 ± 16.7 kJ·mol−1
Dipole Moment 4.58 ± 1.08 D
Volume 296.16 Å 3
Surface Area 264.66 Å 2
HOMO Energy -8.76 ± 0.55 eV
LUMO Energy 1.66 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-thieno(2,3-h)-1-benzopyran-2-one, 3-chloro-4-(dimethylamino)-
  • 3-chloro-4-dimethylamino-2-thieno[2,3-h]chromenone
  • 3-chloro-4-dimethylamino-thieno[2,3-h]chromen-2-one
  • 3-chloro-4-dimethylaminothioangelicin
  • cdata
CAS Number(s)
  • 90236-91-2
InChIKey QTXQUPXOGACDSE-UHFFFAOYSA-N
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