N-Benzylcinchonidinium chloride - CAS 69257-04-1

Inquiry

N-Benzylcinchonidinium Chloride (CAS# 69257-04-1) is a useful research chemical.

Catalog Number

69257-04-1

CAS

69257-04-1

IUPAC Name

(R)-[(2S,4S,5R)-1-benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;chloride

Synonyms

(R)-[(2S,4S,5R)-5-ethenyl-1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octan-2-yl]-(4-quinolinyl)methanol;chloride; (R)-[(2S,4S,5R)-1-benzyl-5-ethenyl-1-azoniabicyclo[2.2.2]octan-2-yl]-quinolin-4-ylmethanol;chloride

Molecular Weight

420.97

Molecular Formula

C26H29ClN2O

Product Information

Canonical SMILES

C=CC1C[N+]2(CCC1CC2C(C3=CC=NC4=CC=CC=C34)O)CC5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C26H29N2O.ClH/c1-2-20-18-28(17-19-8-4-3-5-9-19)15-13-21(20)16-25(28)26(29)23-12-14-27-24-11-7-6-10-22(23)24;/h2-12,14,20-21,25-26,29H,1,13,15-18H2;1H/q+1;/p-1/t20-,21-,25-,26+,28?;/m0./s1

InChI Key

FCHYSBWCOKEPNQ-IOPLZPHGSA-M

Purity

99 %

MDL

MFCD00082422

Physical State

Solid

Appearance

Powder

Storage

Inert atmosphere. Keep cold.

Melting Point

210 °C

Optical Activity

-180° (c=1.3 in water)

Solubility

Other solvents(Soluble) : Methanol

TSCA

WGK Germany

Safety Information

Signal Word

Warning

Precautionary Statement

P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501

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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N-Benzylcinchonidinium chloride - CAS 69257-04-1

Product Information

Safety Information

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