7-Troc-paclitaxel

Cat. No.: PI114915172

Product Details Computed Properties

CAS	114915-17-2
Synonyms	(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-9-(((2R,3S)-3-benzamido-2-hydroxy-3-phenylpropanoyl)oxy)-12-(benzoyloxy)-11-hydroxy-4a,8,13,13-tetramethyl-5-oxo-4-(((2,2,2-trichloroethoxy)carbonyl)oxy)-3,4,4a,5,6,9,10,11,12,12a-decahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxete-6,12b(2aH)-diyl diacetate
Molecular Formula	C50H52Cl3NO16
Molecular Weight	1029.30
Density	1.46±0.1 g/cm3(Predicted)
Boiling Point	1041.1±65.0 °C(Predicted)
Flash Point	583.5±34.3 °C
Refractive Index	1.629

XLogP3	5.3
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	16
Rotatable Bond Count	18
Exact Mass	1027.235168
Monoisotopic Mass	1027.235168
Heavy Atom Count	70
Complexity	2060
Defined Atom Stereocenter Count	11
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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