Threitol 1,4-Bis(Methanesulfonate)

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Properties Simple | Detailed

Formula C6H14O8S2
IUPAC Name [(2r,3r)-2,3-dihydroxy-4-methylsulfonyloxy-butyl] methanesulfonate
Molecular Mass 278.301 g·mol−1
Heat of Formation -1471.9 ± 16.7 kJ·mol−1
Dipole Moment 4.09 ± 1.08 D
Volume 282.68 Å 3
Surface Area 274.99 Å 2
HOMO Energy -10.82 ± 0.55 eV
LUMO Energy 3.33 ± eV
Point Group Symmetry C1
Synonyms
  • 1,2,3,4-butanetetrol, 1,4-dimethanesulfonate, (r-(r*,r*))- (9ci)
  • [(2r,3r)-2,3-dihydroxy-4-methylsulfonyloxy-butyl] methanesulfonate
  • [(2r,3r)-2,3-dihydroxy-4-methylsulfonyloxybutyl] methanesulfonate
  • d-threitol-1,4-bis(methanesulfonate)
  • methanesulfonic acid [(2r,3r)-2,3-dihydroxy-4-methylsulfonyloxy-butyl] ester
  • methanesulfonic acid [(2r,3r)-2,3-dihydroxy-4-methylsulfonyloxybutyl] ester
CAS Number(s)
  • 299-74-1
InChIKey YCPOZVAOBBQLRI-PHDIDXHHSA-N
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