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125749-28-2 | Methanone, 1,1'-[(4-propylphenyl)phosphinylidene]bis[1-(2,6-dichlorophenyl)-
CAS No: 125749-28-2 Catalog No: AG000OMI MDL No:
Product Description
Catalog Number:
AG000OMI
Chemical Name:
Methanone, 1,1'-[(4-propylphenyl)phosphinylidene]bis[1-(2,6-dichlorophenyl)-
CAS Number:
125749-28-2
Molecular Formula:
C23H17Cl4O3P
Molecular Weight:
514.1650
IUPAC Name:
[(2,6-dichlorobenzoyl)-(4-propylphenyl)phosphoryl]-(2,6-dichlorophenyl)methanone
InChI:
InChI=1S/C23H17Cl4O3P/c1-2-5-14-10-12-15(13-11-14)31(30,22(28)20-16(24)6-3-7-17(20)25)23(29)21-18(26)8-4-9-19(21)27/h3-4,6-13H,2,5H2,1H3
InChI Key:
ZEDSKTISNTXEQI-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)P(=O)(C(=O)c1c(Cl)cccc1Cl)C(=O)c1c(Cl)cccc1Cl
Properties
Complexity:
632
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
513.964g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
514.16g/mol
Monoisotopic Mass:
511.967g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
51.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7
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