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4-[4-(Diphenylmethoxy-[d5])-1-piperidinyl]-1-[4-[(2-hydroxy-1,1-dimethyl)ethyl]phenyl]butyne

General Information
Catalog: BLP-007761
CAS: 1189696-09-0
Molecular Formula: C32H32D5NO2
Molecular Weight: 472.67
Chemical Structure
4-[4-(Diphenylmethoxy-[d5])-1-piperidinyl]-1-[4-[(2-hydroxy-1,1-dimethyl)ethyl]phenyl]butyne
Description An isotopic labelled analog of 4-[4-(Diphenylmethoxy)-1-piperidinyl]-1-[4-[(2-hydroxy-1,1-dimethyl)ethyl]phenyl]butyne.
Synonyms 2-methyl-2-[4-(4-{4-[(2,3,4,5-H4)phenyl(phenyl)(H)methoxy]piperidin-1-yl}but-1-yn-1-yl)phenyl]propan-1-ol-d5
IUPAC Name 2-methyl-2-[4-[4-[4-[(2,3,4,5,6-pentadeuteriophenyl)-phenylmethoxy]piperidin-1-yl]but-1-ynyl]phenyl]propan-1-ol
Related CAS 1159977-34-0 (unlabelled)
Canonical SMILES CC(C)(CO)C1=CC=C(C=C1)C#CCCN2CCC(CC2)OC(C3=CC=CC=C3)C4=CC=CC=C4
InChI InChI=1S/C32H37NO2/c1-32(2,25-34)29-18-16-26(17-19-29)11-9-10-22-33-23-20-30(21-24-33)35-31(27-12-5-3-6-13-27)28-14-7-4-8-15-28/h3-8,12-19,30-31,34H,10,20-25H2,1-2H3/i3D,5D,6D,12D,13D
InChI Key ZJJBZCFQCBNUEJ-YDFCRWJESA-N
Purity >98%
Solubility Soluble in Chloroform, Dichloromethane, Ethyl Acetate, Methanol
Appearance Off-white Solid

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