1674-94-8
ENDO-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL 2-HYDROXY-2,2-DIPHENYLACETATE HYDROCHLORIDE
NameENDO-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL 2-HYDROXY-2,2-DIPHENYLACETATE HYDROCHLORIDE
FormulaC22 H25 N O3 . Cl H
1Identification
【Name】
ENDO-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL 2-HYDROXY-2,2-DIPHENYLACETATE HYDROCHLORIDE
【CAS】
【MDL】
MFCD01677440
【English Synonyms】
【Formula】
C22 H25 N O3 . Cl H
【MolWeight】
387.904
【Inchi】
InChI=1S/C22H25NO3.ClH/c1-23-18-12-13-19(23)15-20(14-18)26-21(24)22(25,16-8-4-2-5-9-16)17-10-6-3-7-11-17;/h2-11,18-20,25H,12-15H2,1H3;1H/t18-,19+,20+;
【InChIKey】
InChIKey=KBGDDPWSFYFMKX-BWSPSPBFSA-N
【SMILES】
CN1[C@@H]2CC[C@H]1C[C@H](C2)OC(=O)C(c3ccccc3)(c4ccccc4)O.Cl
【MOL File】
ENDO-8-METHYL-8-AZAB….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ENDO-8-METHYL-8-AZABICYCLO[3.2.1]OCTAN-3-YL 2-HYDROXY-2,2-DIPHENYLACETATE HYDROCHLORIDE.cml