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161265-03-8 | Phosphine, 1,1'-(9,9-dimethyl-9H-xanthene-4,5-diyl)bis[1,1-diphenyl-
CAS No: 161265-03-8 Catalog No: AG001SA9 MDL No:MFCD00233866
Product Description
Catalog Number:
AG001SA9
Chemical Name:
Phosphine, 1,1'-(9,9-dimethyl-9H-xanthene-4,5-diyl)bis[1,1-diphenyl-
CAS Number:
161265-03-8
Molecular Formula:
C39H32OP2
Molecular Weight:
578.6183
MDL Number:
MFCD00233866
IUPAC Name:
(5-diphenylphosphanyl-9,9-dimethylxanthen-4-yl)-diphenylphosphane
InChI:
InChI=1S/C39H32OP2/c1-39(2)33-25-15-27-35(41(29-17-7-3-8-18-29)30-19-9-4-10-20-30)37(33)40-38-34(39)26-16-28-36(38)42(31-21-11-5-12-22-31)32-23-13-6-14-24-32/h3-28H,1-2H3
InChI Key:
CXNIUSPIQKWYAI-UHFFFAOYSA-N
SMILES:
CC1(C)c2cccc(c2Oc2c1cccc2P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
UNII:
NMU72MOG9B
Properties
Complexity:
731
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
578.193g/mol
Formal Charge:
0
Heavy Atom Count:
42
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
578.632g/mol
Monoisotopic Mass:
578.193g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.7
Literature
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