(-)-2,2'-Methylenebis[(3aS,8aR)-3a,8a-dihydro-8H-indeno[1,2-d]oxazole]

Catalog Number	ACM175166491-1
CAS	175166-49-1
Structure
Synonyms	Bis((3aS,8aR)-8,8a-dihydro-3aH-indeno[1,2-d]oxazol-2-yl)methane
IUPAC Name	(3aR,8bS)-2-[[(3aR,8bS)-4,8b-dihydro-3aH-indeno[1,2-d][1,3]oxazol-2-yl]methyl]-4,8b-dihydro-3aH-indeno[1,2-d][1,3]oxazole
Molecular Weight	330.38
Molecular Formula	C21H18N2O2
Canonical SMILES	C1C2C(C3=CC=CC=C31)N=C(O2)CC4=NC5C(O4)CC6=CC=CC=C56
InChI	BDHSVQLSNIGJNC-JYWFKMLOSA-N
InChI Key	InChI=1S/C21H18N2O2/c1-3-7-14-12(5-1)9-16-20(14)22-18(24-16)11-19-23-21-15-8-4-2-6-13(15)10-17(21)25-19/h1-8,16-17,20-21H,9-11H2/t16-,17-,20+,21+/m1/s1
Boiling Point	493.2±45.0 °C(Predicted)
Melting Point	224 °C
Purity	>98.0%(LC)(N)
Appearance	White powder
Complexity	563
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	4
Exact Mass	330.136827821
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isomeric SMILES	C1[C@@H]2[C@H](C3=CC=CC=C31)N=C(O2)CC4=N[C@@H]5[C@H](O4)CC6=CC=CC=C56
Monoisotopic Mass	330.136827821
Rotatable Bond Count	2
Topological Polar Surface Area	43.2 Ų