(9S)-Cinchonan-6',9-diol - CAS 70877-75-7

Inquiry

A metabolite of Quinidine.

Catalog Number

70877-75-7

CAS

70877-75-7

IUPAC Name

4-[(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-hydroxymethyl]quinolin-6-ol

Synonyms

4-[(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-hydroxymethyl]-6-quinolinol; 4-[(S)-[(2R,4S,5R)-5-ethenyl-1-azabicyclo[2.2.2]octan-2-yl]-hydroxymethyl]quinolin-6-ol

Molecular Weight

310.39

Molecular Formula

C19H22N2O2

Product Information

Canonical SMILES

C=CC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)O)O

InChI

InChI=1S/C19H22N2O2/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17/h2-5,7,10,12-13,18-19,22-23H,1,6,8-9,11H2/t12-,13-,18+,19-/m0/s1

InChI Key

VJFMSYZSFUWQPZ-WXPXUSHHSA-N

Storage

Sealed in dry. Keep cold.

Boiling Point

514.6 ℃ / 760 mmHg

Melting Point

167-175 ℃

Density

1.286 g/cm³

Optical Activity

+240° ( c=1 in ethanol)

Safety Information

Signal Word

Warning

Precautionary Statement

P261 - P305 - P351 - P338

Hazard Statements

H315 - H319 - H335

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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(9S)-Cinchonan-6',9-diol - CAS 70877-75-7

Product Information

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