CAS
53448-09-2 Purity
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53448-09-2 Purity
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Ciclonicate
CAS
53449-58-4
Catalog Number
ACM53449584
Category
Other Products
Molecular Weight
247.336
Molecular Formula
C15H21NO2
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Specification
Synonyms
Ciclonicate (INN), SureCN22056, CHEMBL2104521, 53449-58-4, D07173
IUPAC Name
[(1R,5S)-3,3,5-trimethylcyclohexyl] pyridine-3-carboxylate
Canonical SMILES
CC1CC(CC(C1)(C)C)OC(=O)C2=CN=CC=C2
InChI Key
GQSGZTBDVNUIQS-DGCLKSJQSA-N
Boiling Point
325.7ºC at 760mmHg
Flash Point
150.8ºC
Density
1.06g/cm³
EC Number
258-561-4
Exact Mass
247.15700
H-Bond Acceptor
3
H-Bond Donor
0
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