Combretastatin A-4 Phosphate

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Properties Simple | Detailed

Formula C18H21O8P
IUPAC Name [2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl] dihydrogen phosphate
Molecular Mass 396.328 g·mol−1
Heat of Formation -1396.0 ± 16.7 kJ·mol−1
Dipole Moment 2.36 ± 1.08 D
Volume 457.95 Å 3
Surface Area 347.03 Å 2
HOMO Energy -8.72 ± 0.55 eV
LUMO Energy -0.44 ± eV
Point Group Symmetry C1
Synonyms
  • [2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)ethenyl]phenyl] dihydrogen phosphate
  • [2-methoxy-5-[(z)-2-(3,4,5-trimethoxyphenyl)vinyl]phenyl] dihydrogen phosphate
  • phenol, 2-methoxy-5-((1z)-2-(3,4,5-trimethoxyphenyl)ethenyl)-, dihydrogen phosphate
CAS Number(s)
  • 222030-63-9
InChIKey WDOGQTQEKVLZIJ-WAYWQWQTSA-N
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