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Sigma-Aldrich

3-Chloroquinuclidine hydrochloride

98%

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About This Item

Empirical Formula (Hill Notation):
C7H12ClN · HCl
CAS Number:
33601-77-3
Molecular Weight:
182.09
EC Number:
251-586-1
MDL number:
MFCD00012728
UNSPSC Code:
12352100
PubChem Substance ID:
24847656
NACRES:
NA.22

Assay

98%

mp

236-239 °C (lit.)

SMILES string

Cl.ClC1CN2CCC1CC2

InChI

1S/C7H12ClN.ClH/c8-7-5-9-3-1-6(7)2-4-9;/h6-7H,1-5H2;1H

InChI key

OOMINTVSHDCDRK-UHFFFAOYSA-N

Application

3-Chloroquinuclidine hydrochloride has been used in determination of equilibrium constants in D2O for the formation of imines/iminium ions from addition of glycine methyl ester to acetone and from addition of glycine to phenylglyoxylate by 1H-NMR analysis.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Juan Crugeiras et al.
Journal of the American Chemical Society, 130(6), 2041-2050 (2008-01-18)
Equilibrium constants in D2O were determined by 1H NMR analyses for formation of imines/iminium ions from addition of glycine methyl ester to acetone and from addition of glycine to phenylglyoxylate. First-order rate constants, also determined by 1H NMR, are reported

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