(3S,4R)-Cabastine-D4 Hydrochloride
Product Code
TRC-C045502-75MG
Product Format
Neat
Molecular Formula
C₂₆H₂₅D₄FN₂O₂ • (HCl)
Molecular Weight
461.01
Product Categories
Product Type
Stable Isotope LabelledAlternate CAS Number
Unlabelled CAS Number
Price and availability
Product Information
Product Data
Analyte Name
(3S,4R)-Cabastine-D4 Hydrochloride
Molecular Formula
C₂₆H₂₅D₄FN₂O₂ • (HCl)
Molecular Weight
461.01
Accurate Mass
460.23
SMILES
[2H]C1(C[C@@](C#N)(CC([2H])([C@@]1([H])N2CC[C@@](C(O)=O)([C@@]([H])(C2)C)C3=CC=CC=C3)[2H])C4=CC=C(C=C4)F)[2H].Cl
InChI
InChI=1S/C26H29FN2O2.ClH/c1-19-17-29(16-15-26(19,24(30)31)21-5-3-2-4-6-21)23-11-13-25(18-28,14-12-23)20-7-9-22(27)10-8-20;/h2-10,19,23H,11-17H2,1H3,(H,30,31);1H/t19-,23-,25-,26-;/m1./s1/i11D2,12D2;
IUPAC
(3S,4R)-1-((1s,4R)-4-cyano-4-(4-fluorophenyl)cyclohexyl-2,2,6,6-d4)-3-methyl-4-phenylpiperidine-4-carboxylic acid
Alternate CAS Number
724694-34-2
Unlabelled CAS Number
79516-67-9
SIL Type
Deuterium
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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