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14224-99-8 | Oxazole, 2-methyl-4,5-diphenyl-
CAS No: 14224-99-8 Catalog No: AG001I16 MDL No:MFCD00005307
Product Description
Catalog Number:
AG001I16
Chemical Name:
Oxazole, 2-methyl-4,5-diphenyl-
CAS Number:
14224-99-8
Molecular Formula:
C16H13NO
Molecular Weight:
235.2805
MDL Number:
MFCD00005307
IUPAC Name:
2-methyl-4,5-diphenyl-1,3-oxazole
InChI:
InChI=1S/C16H13NO/c1-12-17-15(13-8-4-2-5-9-13)16(18-12)14-10-6-3-7-11-14/h2-11H,1H3
InChI Key:
QLQIWRCWPJRJJA-UHFFFAOYSA-N
SMILES:
Cc1nc(c(o1)c1ccccc1)c1ccccc1
Properties
Complexity:
256
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.1g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
235.286g/mol
Monoisotopic Mass:
235.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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