84435-09-6
1-AZABICYCLO(2.2.2)OCTANE-3-METHANOL, ALPHA,ALPHA-BIS(2-METHYLPHENYL)-, 1-OXIDE
Name1-AZABICYCLO(2.2.2)OCTANE-3-METHANOL, ALPHA,ALPHA-BIS(2-METHYLPHENYL)-, 1-OXIDE
1Identification
【Name】
1-AZABICYCLO(2.2.2)OCTANE-3-METHANOL, ALPHA,ALPHA-BIS(2-METHYLPHENYL)-, 1-OXIDE
【CAS】
【MDL】
MFCD01684883
【English Synonyms】
【Formula】
C22 H27 N O2
【MolWeight】
337.46
【Inchi】
InChI=1S/C22H27NO2/c1-16-7-3-5-9-19(16)22(24,20-10-6-4-8-17(20)2)21-15-23(25)13-11-18(21)12-14-23/h3-10,18,21,24H,11-15H2,1-2H3/t18-,21?,23?
【InChIKey】
InChIKey=SPOKVDPKWUZBJS-FYFBIHARSA-N
【SMILES】
Cc1ccccc1C(c2ccccc2C)(C3C[N+]4(CC[C@H]3CC4)[O-])O
【MOL File】
1-AZABICYCLO(2.2.2)O….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-AZABICYCLO(2.2.2)OCTANE-3-METHANOL, ALPHA,ALPHA-BIS(2-METHYLPHENYL)-, 1-OXIDE.cml