Identification Chemical Properties Supplier

937245-42-6

Name (2R,3R,11bR)-9-(3-fluoropropoxy)-3-isobutyl-10-methoxy-2,3,4,6,7,11b-hexahydro-1H-pyrido[2,1-a]isoquinolin-2-ol
CAS 937245-42-6
Molecular Formula C21H32FNO3
Molecular Weight 365.48
MOL File 937245-42-6.mol
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Chemical Properties

Boiling point  496.0±45.0 °C(Predicted)
density  1.14±0.1 g/cm3(Predicted)
pka 14.75±0.40(Predicted)
InChI InChI=1S/C21H32FNO3/c1-14(2)9-16-13-23-7-5-15-10-21(26-8-4-6-22)20(25-3)11-17(15)18(23)12-19(16)24/h10-11,14,16,18-19,24H,4-9,12-13H2,1-3H3/t16-,18-,19-/m1/s1
InChIKey GNKGXQHHUUEYQV-BHIYHBOVSA-N
SMILES C12=CC(OC)=C(OCCCF)C=C1CCN1[C@]2([H])C[C@@H](O)[C@H](CC(C)C)C1

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