AG001MOO

150529-93-4 | Oxazole, 2,2'-(1-methylethylidene)bis[4,5-dihydro-4-phenyl-, (4R,4'R)-

AG001MOO

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CAS Number	150529-93-4
Catalog Number	AG001MOO(AGN-PC-0Q4UWL)
Chemical Name	Oxazole, 2,2'-(1-methylethylidene)bis[4,5-dihydro-4-phenyl-, (4R,4'R)-
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
InChI	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
InChI Key	JTNVCJCSECAMLD-ROUUACIJSA-N
MDL Number	MFCD00192244
Molecular Formula	C21H22N2O2
Molecular Weight	334.4116
SMILES	CC(C1=N[C@@H](CO1)c1ccccc1)(C1=N[C@@H](CO1)c1ccccc1)C
UNII	CG7P67W7W0
Synonyms	150529-93-4, (+)-2,2'-Isopropylidenebis[(4R)-4-phenyl-2-oxazoline], (R,R)-2,2'-Isopropylidenebis(4-phenyl-2-oxazoline), UNII-CG7P67W7W0, CG7P67W7W0, OXAZOLE, 2,2'-(1-METHYLETHYLIDENE)BIS[4,5-DIHYDRO-4-PHENYL-, (4R,4'R)-, (R,R)-2,2'-(Dimethylmethylene)bis(4-phenyl-2-oxazoline), (R)-(+)-2,2'-ISOPROPYLIDENEBIS(4-PHENYL-2-OXAZOLINE), (4R,4'R)-2,2'-(propane-2,2-diyl)bis(4-phenyl-4,5-dihydrooxazole), (R,R)-2,2'-Bis(4-phenyl-2-oxazolin-2-yl)propane, (R,R)-2,2-Bis(4-phenyl-2-oxazolin-2-yl)propane, (R,R)-2,2-(DIMETHYLMETHYLENE)BIS(4-PHENYL-2-OXAZOLINE), Ph-box, (R,R)-, Oxazole, 2,2'-(1-methylethylidene)bis(4,5-dihydro-4-phenyl-, (4R,4'R)-, (R,R)-Ph-box, (R,R)-Ph-box [MI], (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, (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, AC1LDWHT, Bis(oxazoline) ligands (R,R)-ph-box [MI], (R,R)-2,2-Isopropylidenebis(4-phenyl-2-oxazoline), Bis(oxazoline) ligands derivative (R,R)-ph-box, SCHEMBL249479, (+)-2,2'-Isopropylidenebis, ZINC39431, 2,2-Bis((4R)-4,5-dihydro-4-phenyloxazol-2-yl)propane, JTNVCJCSECAMLD-ROUUACIJSA-N, KS-000012AC, 7543AA, ANW-21283, MFCD00192244, AKOS015838409, FS-6030, SC11772, AJ-08840, ZB001129, TC-110028, TR-006149, D2823, FT-0643460, 529I934, 2,2'-Isopropylidenebis[(R)-4-phenyl-2-oxazoline], J-008716, 2,2'-isopropylidenebis[(4R)-4-phenyl-2-oxazoline], 2,2-bis[(4r)-4-phenyl-1,3-oxazolin-2-yl] propane, I14-45295, (+)-2,2-Isopropylidenebis[(4R)-4-phenyl-2-oxazoline], (R)-(+)-2,2-Isopropylidenebis(4-phenyl-2-oxazoline), R,R)-2,2'-ISOPROPYLIDENEBIS(4-PHENYL-2-OXAZOLINE, (+)-2,2'-Isopropylidenebis[(4R)-4-phenyl-2-oxazoline], 97%, C21H22N2O2, CID676390, ZINC00039428, ( )-2,2'-Isopropylidenebis[(4R)-4-phenyl-2-oxazoline], 97% - 1G 1g, 131457-46-0,

Complexity	482
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Exact Mass	334.168g/mol
Formal Charge	0
Heavy Atom Count	25
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	334.419g/mol
Monoisotopic Mass	334.168g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	43.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	6.1
Hazard statements	H301+H311+H331
Packing Group	Ⅲ
Precautionary statements	P261-P280-P301+P310-P311
UN Code	UN 2811

Certificate of Analysis

Lot Number