N,N-Bis(2-((4-Tolylsulfonyl)Oxy)Ethyl)-4-Methoxy-2,3,6-Trimethylbenzenesulfonamide

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Formula C28H35NO9S3
IUPAC Name 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-[2-(p-tolylsulfonyloxy)ethyl]amino]ethyl 4-methylbenzenesulfonate
Molecular Mass 625.774 g·mol−1
Heat of Formation -1448.5 ± 16.7 kJ·mol−1
Dipole Moment 11.18 ± 1.08 D
Volume 696.51 Å 3
Surface Area 452.58 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -0.92 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl 4-methylbenzenesulfonate
  • 4-methylbenzenesulfonic acid 2-[(4-methoxy-2,3,6-trimethyl-phenyl)sulfonyl-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl ester
  • 4-methylbenzenesulfonic acid 2-[(4-methoxy-2,3,6-trimethylphenyl)sulfonyl-[2-(4-methylphenyl)sulfonyloxyethyl]amino]ethyl ester
  • benzenesulfonamide, 4-methoxy-2,3,6-trimethyl-n,n-bis(2-(((4-methylphenyl)sulfonyl)oxy)ethyl)-
  • bis(tsoe)-mbs
CAS Number(s)
  • 147597-63-5
InChIKey LZWMKXPKGLLVQP-UHFFFAOYSA-N
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