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147438-64-0 | Oxazole, 4-[(1E)-3-(diphenylphosphinyl)-2-methyl-1-propen-1-yl]-2-methyl-
CAS No: 147438-64-0 Catalog No: AG001EW8 MDL No:
Product Description
Catalog Number:
AG001EW8
Chemical Name:
Oxazole, 4-[(1E)-3-(diphenylphosphinyl)-2-methyl-1-propen-1-yl]-2-methyl-
CAS Number:
147438-64-0
Molecular Formula:
C20H20NO2P
Molecular Weight:
337.3521
IUPAC Name:
4-(3-diphenylphosphoryl-2-methylprop-1-enyl)-2-methyl-1,3-oxazole
InChI:
InChI=1S/C20H20NO2P/c1-16(13-18-14-23-17(2)21-18)15-24(22,19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-14H,15H2,1-2H3
InChI Key:
SVWWJIUIPFHJRO-UHFFFAOYSA-N
SMILES:
C/C(=C\c1coc(n1)C)/CP(=O)(c1ccccc1)c1ccccc1
Properties
Complexity:
456
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
337.123g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.359g/mol
Monoisotopic Mass:
337.123g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
4.1
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