(R,R)-t-Bu-box

Catalog Number	ACM131833971-1
CAS	131833-97-1
Structure
Synonyms	(4R,4'R)-2,2'-(Propane-2,2-diyl)bis(4-(tert-butyl)-4,5-dihydrooxazole); (R,R)-(-)-2,2'-Isopropylidenebis(4-tert-butyl-2-oxazoline)
IUPAC Name	(4R)-4-tert-butyl-2-[2-[(4R)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]propan-2-yl]-4,5-dihydro-1,3-oxazole
Molecular Weight	294.43
Molecular Formula	C17H30N2O2
Canonical SMILES	CC(C)(C)C1COC(=N1)C(C)(C)C2=NC(CO2)C(C)(C)C
InChI	DPMGLJUMNRDNMX-RYUDHWBXSA-N
InChI Key	InChI=1S/C17H30N2O2/c1-15(2,3)11-9-20-13(18-11)17(7,8)14-19-12(10-21-14)16(4,5)6/h11-12H,9-10H2,1-8H3/t11-,12-/m0/s1
Boiling Point	350.4±25.0 °C(Predicted)
Melting Point	88-92 °C
Exact Mass	294.230728204
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isomeric SMILES	CC(C)(C)[C@@H]1COC(=N1)C(C)(C)C2=N[C@@H](CO2)C(C)(C)C
Monoisotopic Mass	294.230728204
Rotatable Bond Count	4
Topological Polar Surface Area	43.2 Ų