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2397-01-5 | 2,2'-(Vinylenedi-p-phenylene)bis[5-tert-butylbenzoxazole]
CAS No: 2397-01-5 Catalog No: AG01E766 MDL No:
Product Description
Catalog Number:
AG01E766
Chemical Name:
2,2'-(Vinylenedi-p-phenylene)bis[5-tert-butylbenzoxazole]
CAS Number:
2397-01-5
IUPAC Name:
5-tert-butyl-2-[4-[(E)-2-[4-(5-tert-butyl-1,3-benzoxazol-2-yl)phenyl]ethenyl]phenyl]-1,3-benzoxazole
InChI:
InChI=1S/C36H34N2O2/c1-35(2,3)27-17-19-31-29(21-27)37-33(39-31)25-13-9-23(10-14-25)7-8-24-11-15-26(16-12-24)34-38-30-22-28(36(4,5)6)18-20-32(30)40-34/h7-22H,1-6H3/b8-7+
InChI Key:
PSVDQOKAQPGOLT-BQYQJAHWSA-N
EC Number:
219-261-9
Properties
Complexity:
787
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
526.262g/mol
Formal Charge:
0
Heavy Atom Count:
40
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
526.68g/mol
Monoisotopic Mass:
526.262g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10.5
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