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(8α,9R)-Cinchonan-6′,9-diol

(8α,9R)-Cinchonan-6′,9-diol structure

CAS No:
524-63-0
Formula:
C19H22N2O2
Chemical Name:
(8α,9R)-Cinchonan-6′,9-diol
Synonyms:
Cinchonan-6′,9-diol,(8α,9R)-;Cupreine;(8α,9R)-Cinchonan-6′,9-diol;O6′-Demethylquinine;Ultraquinine;O-Demethylquinine;Desmethylquinine;6-Hydroxycinchonidine;30628-36-5;1906205-94-4

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Description

Pale Yellow Solid

(8α,9R)-Cinchonan-6′,9-diol Basic Attributes

Molecular Weight：

310.39000

Exact Mass：

310.39

EC Number：

208-363-9

HScode：

2933990090

Characteristics

PSA：

56.59000

XLogP3：

2.80810

Density：

1.28g/cm3

Melting Point：

202 °C

Boiling Point：

514.6ºC at 760mmHg

Flash Point：

265ºC

Refractive Index：

1.677

Drug Information

MeSH Entry Terms：

6'-hydroxycinchonidine

(8α,9R)-Cinchonan-6′,9-diol Use and Manufacturing

A metabolite of Quinine (Q694000).

Computed Properties

Molecular Weight:310.4
XLogP3:2.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:310.168127949
Monoisotopic Mass:310.168127949
Topological Polar Surface Area:56.6
Heavy Atom Count:23
Complexity:443
Undefined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of (8α,9R)-Cinchonan-6′,9-diol

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties

(8α,9R)-Cinchonan-6′,9-diol

SDS

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