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16822-31-4 | Phosphine sulfide, bis(4-methylphenyl)phenyl-
CAS No: 16822-31-4 Catalog No: AG001XY7 MDL No:
Product Description
Catalog Number:
AG001XY7
Chemical Name:
Phosphine sulfide, bis(4-methylphenyl)phenyl-
CAS Number:
16822-31-4
Molecular Formula:
C20H19PS
Molecular Weight:
322.4036
IUPAC Name:
bis(4-methylphenyl)-phenyl-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/C20H19PS/c1-16-8-12-19(13-9-16)21(22,18-6-4-3-5-7-18)20-14-10-17(2)11-15-20/h3-15H,1-2H3
InChI Key:
HBTVPYKDOWMLIA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)P(=S)(c1ccc(cc1)C)c1ccccc1
Properties
Complexity:
357
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.095g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.406g/mol
Monoisotopic Mass:
322.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.5
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