CAS
113170-86-8 Purity
>99 %
113170-86-8 Purity
>99 %
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Hydroquinine 4-chlorobenzoate,98%
CAS
113216-88-9
Catalog Number
ACM113216889
Category
Other Products
Molecular Weight
464.98
Molecular Formula
C27H29ClN2O3
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Specification
Synonyms
Hydroquinine 4-chlorobenzoate, Dihydroquinine 4-chlorobenzoate, O-(4-Chlorobenzoyl)hydroquinine, SureCN3959572, 113216-88-9
IUPAC Name
[(R)-[(2S,4S,5R)-5-ethyl-1-azabicyclo[2.2.2]octan-2-yl]-(6-methoxyquinolin-4-yl)methyl] 4-chlorobenzoate
Canonical SMILES
CCC1CN2CCC1CC2C(C3=C4C=C(C=CC4=NC=C3)OC)OC(=O)C5=CC=C(C=C5)Cl
InChI Key
TXVNNFDXQZFMBQ-MFQNCIFPSA-N
Boiling Point
598ºC at 760mmHg
Melting Point
128-130ºC(lit.)
Flash Point
315.5ºC
Density
1.28g/cm³
Exact Mass
464.18700
H-Bond Acceptor
5
H-Bond Donor
0
Packing Group
III
Safety Description
S22-S24/25
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