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3,5-di-tert-Butyl-4-hydroxybenzaldehyde
CAS: 1620-98-0
Starting at
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Catalog No.BB 0277624
ClassAromatic Compounds
Purity—
(1R,2R,5R)-2-(4-(4-Fluorophenyl)-1H-1,2,3-triazol-1-yl)-7-oxaspiro[4.6]undec-9-en-1-ol
Formula: C₁₈H₂₀FN₃O₂MW: 329.375CAS: —Catalog: BB 0271794
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2D structure · rendered from MDL/SMILES
Catalog IDBB 0271794
Molecular FormulaC18H20FN3O2
Molecular Weight329.4 g/mol
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Molecular Formula
C18H20FN3O2
Molecular Weight
329.4 g/mol
Topological Polar Surface Area
60.2
XLogP
1.9
Charge
0
Exact Mass
329.15395505
IUPAC Name
(3R,4R,5R)-3-[4-(4-fluorophenyl)triazol-1-yl]-7-oxaspiro[4.6]undec-9-en-4-ol
Complexity
469
Heavy Atom Count
24
Hydrogen Bond Donor Count
1
Monoisotopic Mass
329.15395505
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
2
Canonical SMILES
O[C@H]1[C@H](n2cc(-c3ccc(F)cc3)nn2)CC[C@]12CC=CCOC2