59889-36-0
CIPREFADOL
Name
CIPREFADOL
Formula
C19 H27 N O
MolWeight
285.428
1Identification
【Name】
CIPREFADOL
【CAS】
【MDL】
MFCD00864273
【English Synonyms】
【Formula】
C19 H27 N O
【MolWeight】
285.428
【Inchi】
InChI=1S/C19H27NO/c21-18-6-3-5-16(12-18)19-9-2-1-4-17(19)14-20(11-10-19)13-15-7-8-15/h3,5-6,12,15,17,21H,1-2,4,7-11,13-14H2/t17-,19-/m0/s1
【InChIKey】
InChIKey=KFIQKMINEHFZSM-HKUYNNGSSA-N
【SMILES】
c1cc(cc(c1)O)[C@@]23CCCC[C@H]2CN(CC3)CC4CC4
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
CIPREFADOL.cml
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