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828282-67-3 | Phosphine sulfide, (3,7-dimethyl-2,6-octadienyl)diphenyl-
CAS No: 828282-67-3 Catalog No: AG0055P0 MDL No:
Product Description
Catalog Number:
AG0055P0
Chemical Name:
Phosphine sulfide, (3,7-dimethyl-2,6-octadienyl)diphenyl-
CAS Number:
828282-67-3
Molecular Formula:
C22H27PS
Molecular Weight:
354.4885
IUPAC Name:
3,7-dimethylocta-2,6-dienyl-diphenyl-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/C22H27PS/c1-19(2)11-10-12-20(3)17-18-23(24,21-13-6-4-7-14-21)22-15-8-5-9-16-22/h4-9,11,13-17H,10,12,18H2,1-3H3
InChI Key:
YNFDJYORWMLILX-UHFFFAOYSA-N
SMILES:
CC(=CCP(=S)(c1ccccc1)c1ccccc1)CCC=C(C)C
Properties
Complexity:
450
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
354.157g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
354.492g/mol
Monoisotopic Mass:
354.157g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
32.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
7.6
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