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131833-97-1 | Oxazole, 2,2'-(1-methylethylidene)bis[4-(1,1-dimethylethyl)-4,5-dihydro-, (4R,4'R)-
CAS No: 131833-97-1 Catalog No: AG000ZSM MDL No:MFCD07368371
Product Description
Catalog Number:
AG000ZSM
Chemical Name:
Oxazole, 2,2'-(1-methylethylidene)bis[4-(1,1-dimethylethyl)-4,5-dihydro-, (4R,4'R)-
CAS Number:
131833-97-1
Molecular Formula:
C17H30N2O2
Molecular Weight:
294.4323
MDL Number:
MFCD07368371
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
InChI:
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
InChI Key:
DPMGLJUMNRDNMX-RYUDHWBXSA-N
SMILES:
CC(C1=N[C@@H](CO1)C(C)(C)C)(C1=N[C@@H](CO1)C(C)(C)C)C
UNII:
A3955GJ8RU
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
294.231g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.439g/mol
Monoisotopic Mass:
294.231g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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