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2,6-Bis[(4S)-4-tert-butyloxazolin-2-yl]pyridine

Catalog Number ACM118949636-1
CAS 118949-63-6
Structure 2,6-Bis[(4S)-4-tert-butyloxazolin-2-yl]pyridine
Synonyms (4S)-4-Tert-butyl-2-[6-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]pyridin-2-yl]-4,5-dihydro-1,3-oxazole
IUPAC Name (4S)-4-tert-butyl-2-[6-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]pyridin-2-yl]-4,5-dihydro-1,3-oxazole
Molecular Weight 329.44
Molecular Formula C19H27N3O2
Canonical SMILES CC(C)(C)C1COC(=N1)C2=NC(=CC=C2)C3=NC(CO3)C(C)(C)C
InChI UBWMXPSQXYYPJG-HUUCEWRRSA-N
InChI Key InChI=1S/C19H27N3O2/c1-18(2,3)14-10-23-16(21-14)12-8-7-9-13(20-12)17-22-15(11-24-17)19(4,5)6/h7-9,14-15H,10-11H2,1-6H3/t14-,15-/m1/s1
Boiling Point 467.1±30.0 °C(Predicted)
Exact Mass 329.21032711
Heavy Atom Count 24
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
Isomeric SMILES CC(C)(C)[C@H]1COC(=N1)C2=NC(=CC=C2)C3=N[C@H](CO3)C(C)(C)C
Monoisotopic Mass 329.21032711
Rotatable Bond Count 4
Topological Polar Surface Area 56.1 Ų

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