Basic information
- Name:
Quinine phosphinate
- CAS No.:
6119-53-5
- Molecular Structure:
- Formula:
- C20H25N2O4P
- Molecular Weight:
- 388.3973
- Synonyms:
- (5-ethenyl-1-azabicyclo[2.2.2]oct-7-yl)-(6-methoxyquinolin-4-yl)methanol; phosphenous acid;QUININE HYPOPHOSPHITE;
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Specification
The Quinine phosphinate is an organic compound with the formula C20H25N2O4P. The IUPAC name of this chemical is (5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl)-(6-methoxyquinolin-4-yl)methanol; phosphenous acid. With the CAS registry number 6119-53-5, it is also named as Quinine hypophosphite.
Physical properties about Quinine phosphinate are: (1)#H bond acceptors: 6; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 5; (4)Polar Surface Area: 117.03 Å2.
You can still convert the following datas into molecular structure:
(1)SMILES: OP=O.COc1cc2c(cc1)nccc2[C@@H](O)[C@@H]4C[C@@H]3CC[N@]4C[C@@H]3C=C
(2)InChI: InChI=1/C20H24N2O2.HO2P/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;1-3-2/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H,1,2)/t13-,14-,19-,20+;/m0./s1
(3)InChIKey: JWAMXEJYDDQVAR-DSXUQNDKBV
(4)Std. InChI: InChI=1S/C20H24N2O2.HO2P/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;1-3-2/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;(H,1,2)/t13-,14-,19-,20+;/m0./s1
(5)Std. InChIKey: JWAMXEJYDDQVAR-DSXUQNDKSA-N