(+)-2,2'-Isopropylidenebis[(4R)-4-phenyl-2-oxazoline]

Catalog Number	ACM150529934-1
CAS	150529-93-4
Structure
Synonyms	(R,R)-Ph-box; (R,R)-2,2'-Isopropylidenebis(4-phenyl-2-oxazoline)
IUPAC Name	(4R)-4-phenyl-2-[2-[(4R)-4-phenyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4,5-dihydro-1,3-oxazole
Molecular Weight	334.41
Molecular Formula	C21H22N2O2
Canonical SMILES	CC(C)(C1=NC(CO1)C2=CC=CC=C2)C3=NC(CO3)C4=CC=CC=C4
InChI	JTNVCJCSECAMLD-ROUUACIJSA-N
InChI Key	InChI=1S/C21H22N2O2/c1-21(2,19-22-17(13-24-19)15-9-5-3-6-10-15)20-23-18(14-25-20)16-11-7-4-8-12-16/h3-12,17-18H,13-14H2,1-2H3/t17-,18-/m0/s1
Boiling Point	468.9°C at 760 mmHg
Melting Point	56-58 °C-lit.
Exact Mass	334.168127949
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isomeric SMILES	CC(C)(C1=N[C@@H](CO1)C2=CC=CC=C2)C3=N[C@@H](CO3)C4=CC=CC=C4
Monoisotopic Mass	334.168127949
Rotatable Bond Count	4
Topological Polar Surface Area	43.2 Ų