(8a)-6'-methoxycinchonan-9-one
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Product Description
Product
(8a)-6'-methoxycinchonan-9-one
CAS
84-31-1
Formula
C20H22N2O2
Synonym
QUININONE (50 MG); (8a)-6'-Methoxycinchonan-9-one; (8alpha)-6'-methoxycinchonan-9-one; Cinchonan-9-one, 6'-methoxy-, (8alpha)-; EINECS 201-524-4; NSC 15307; Quininoe; Quininone; Quininone (Quinine Sulfate IMpurity); UNII-956671AJG7; (5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-(6-methoxyquinolin-4-yl)methanone; (6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanone
Typical Product Specifications
Molecular weight
322.40
EINECS
201-524-4
SMILES
COc1ccc2c(c1)c(ccn2)C(=O)[C@@H]3C[C@@H]4CC[N@]3C[C@@H]4C=C
InChI
SRFCUPVBYYAMIL-NJSLBKSFSA-N
InChIKey
1S/C20H22N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19H,1,7,9-10,12H2,2H3/t13-,14-,19-/m0/s1
Atmospheric OH Rate Constant
1.11E-10 cm3/molecule-sec
Melting Point
108 ° C
log P (octanol-water)
4.240
Water solubility
3 mg/L
Class
(8a)-6'-methoxycinchonan-9-one
Product Description
Product
(8a)-6'-methoxycinchonan-9-one
CAS
84-31-1
Formula
C20H22N2O2
Synonym
QUININONE (50 MG); (8a)-6'-Methoxycinchonan-9-one; (8alpha)-6'-methoxycinchonan-9-one; Cinchonan-9-one, 6'-methoxy-, (8alpha)-; EINECS 201-524-4; NSC 15307; Quininoe; Quininone; Quininone (Quinine Sulfate IMpurity); UNII-956671AJG7; (5-ethenyl-1-azabicyclo[2.2.2]octan-7-yl)-(6-methoxyquinolin-4-yl)methanone; (6-methoxy-4-quinolyl)-(5-vinylquinuclidin-2-yl)methanone
Typical Product Specifications
Molecular weight
322.40
EINECS
201-524-4
SMILES
COc1ccc2c(c1)c(ccn2)C(=O)[C@@H]3C[C@@H]4CC[N@]3C[C@@H]4C=C
InChI
SRFCUPVBYYAMIL-NJSLBKSFSA-N
InChIKey
1S/C20H22N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19H,1,7,9-10,12H2,2H3/t13-,14-,19-/m0/s1
Atmospheric OH Rate Constant
1.11E-10 cm3/molecule-sec
Melting Point
108 ° C
log P (octanol-water)
4.240
Water solubility
3 mg/L
Class
