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832076-72-9 | Oxazole, 2-[1,1'-biphenyl]-4-yl-4,5-dimethyl-
CAS No: 832076-72-9 Catalog No: AG00597M MDL No:
Product Description
Catalog Number:
AG00597M
Chemical Name:
Oxazole, 2-[1,1'-biphenyl]-4-yl-4,5-dimethyl-
CAS Number:
832076-72-9
Molecular Formula:
C17H15NO
Molecular Weight:
249.3071
IUPAC Name:
4,5-dimethyl-2-(4-phenylphenyl)-1,3-oxazole
InChI:
InChI=1S/C17H15NO/c1-12-13(2)19-17(18-12)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11H,1-2H3
InChI Key:
PPUKCFTXTVKBQH-UHFFFAOYSA-N
SMILES:
Cc1nc(oc1C)c1ccc(cc1)c1ccccc1
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.115g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.313g/mol
Monoisotopic Mass:
249.115g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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