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84048-04-4 | Oxazole, 5-[1,1'-biphenyl]-4-yl-2-(3-bromophenyl)-
CAS No: 84048-04-4 Catalog No: AG004U5X MDL No:
Product Description
Catalog Number:
AG004U5X
Chemical Name:
Oxazole, 5-[1,1'-biphenyl]-4-yl-2-(3-bromophenyl)-
CAS Number:
84048-04-4
Molecular Formula:
C21H14BrNO
Molecular Weight:
376.2460
IUPAC Name:
2-(3-bromophenyl)-5-(4-phenylphenyl)-1,3-oxazole
InChI:
InChI=1S/C21H14BrNO/c22-19-8-4-7-18(13-19)21-23-14-20(24-21)17-11-9-16(10-12-17)15-5-2-1-3-6-15/h1-14H
InChI Key:
IZNRJSPDJGNMCR-UHFFFAOYSA-N
SMILES:
Brc1cccc(c1)c1ncc(o1)c1ccc(cc1)c1ccccc1
Properties
Complexity:
389
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
375.026g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.253g/mol
Monoisotopic Mass:
375.026g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
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