Ethyl (3-Benzoylphenyl)[(Trifluoromethyl)Sulfonyl]Carbamate

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Properties Simple | Detailed

Formula C17H14F3NO5S
IUPAC Name ethyl n-(3-benzoylphenyl)-n-(trifluoromethylsulfonyl)carbamate
Molecular Mass 401.357 g·mol−1
Heat of Formation -1250.3 ± 16.7 kJ·mol−1
Dipole Moment 6.17 ± 1.08 D
Volume 417.35 Å 3
Surface Area 341.82 Å 2
HOMO Energy -9.95 ± 0.55 eV
LUMO Energy -1.33 ± eV
Point Group Symmetry C1
Synonyms
  • (3-benzoylphenyl)((trifluoromethyl)sulfonyl)carbamic acid, ethyl ester
  • ba 4223
  • carbamic acid, (3-benzoylphenyl)((trifluoromethyl)sulfonyl)-, ethyl ester
  • carbanilic acid, m-benzoyl-n-((trifluoromethyl)sulfonyl)-, ethyl ester
  • d06232
  • ethyl m-benzoyl-n-((trifluoromethyl)sulfonyl)carbanilate
  • ethyl n-(3-phenylcarbonylphenyl)-n-(trifluoromethylsulfonyl)carbamate
  • mbr 4223
  • n-[3-(benzoyl)phenyl]-n-triflyl-carbamic acid ethyl ester
  • n-[3-(oxo-phenylmethyl)phenyl]-n-(trifluoromethylsulfonyl)carbamic acid ethyl ester
  • triflumidate
  • triflumidate (usan)
CAS Number(s)
  • 24243-89-8
InChIKey ULANGSAJTINEBA-UHFFFAOYSA-N
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