119952-85-1
1H-IMIDAZOLE-1-ETHANOL, ALPHA-(((5A,6,7,8,9,9A-HEXAHYDRO-2-DIBENZOFURANYL)OXY)METHYL)-, MONOHYDROCHLORIDE
Name1H-IMIDAZOLE-1-ETHANOL, ALPHA-(((5A,6,7,8,9,9A-HEXAHYDRO-2-DIBENZOFURANYL)OXY)METHYL)-, MONOHYDROCHLORIDE
FormulaC18 H22 N2 O3 . Cl H
1Identification
【Name】
1H-IMIDAZOLE-1-ETHANOL, ALPHA-(((5A,6,7,8,9,9A-HEXAHYDRO-2-DIBENZOFURANYL)OXY)METHYL)-, MONOHYDROCHLORIDE
【CAS】
【MDL】
MFCD01721479
【English Synonyms】
【Formula】
C18 H22 N2 O3 . Cl H
【MolWeight】
350.844
【Inchi】
InChI=1S/C18H22N2O3.ClH/c21-13(10-20-8-7-19-12-20)11-22-14-5-6-18-16(9-14)15-3-1-2-4-17(15)23-18;/h5-9,12-13,15,17,21H,1-4,10-11H2;1H
【InChIKey】
InChIKey=RKQOYLWYSQUFLS-UHFFFAOYSA-N
【SMILES】
c1cc2c(cc1OCC(Cn3ccnc3)O)C4CCCCC4O2.Cl
【MOL File】
1H-IMIDAZOLE-1-ETHAN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1H-IMIDAZOLE-1-ETHANOL, ALPHA-(((5A,6,7,8,9,9A-HEXAHYDRO-2-DIBENZOFURANYL)OXY)METHYL)-, MONOHYDROCHLORIDE.cml