200808-74-8
[RH COD (R)-PHANEPHOS] O3SCF3
Name[RH COD (R)-PHANEPHOS] O3SCF3
1Identification
【Name】
[RH COD (R)-PHANEPHOS] O3SCF3
【CAS】
【MDL】
MFCD16294976
【English Synonyms】
【Formula】
C49H46F3O3P2RhS
【MolWeight】
936.817
【Inchi】
InChI=1S/C40H34P2.C8H12.CHF3O3S.Rh/c1-5-13-35(14-6-1)41(36-15-7-2-8-16-36)39-29-31-21-25-33(39)27-23-32-22-26-34(28-24-31)40(30-32)42(37-17-9-3-10-18-37)38-19-11-4-12-20-38;1-2-4-6-8-7-5-3-1;2-1(3,4)8(5,6)7;/h1-22,25-26,29-30H,23-24,27-28H2;1-2,7-8H,3-6H2;(H,5,6,7);/q;;;+1/p-1/b;2-1-,8-7-;;
【InChIKey】
InChIKey=BMDMPSRFVYFVHQ-ONEVTFJLSA-M
【SMILES】
[Rh+].[O-]S(=O)(=O)C(F)(F)F.C1C\C=C/CC\C=C/1.C1CC2=CC=C(CCC3=C(C=C1C=C3)P(C1=CC=CC=C1)C1=CC=CC=C1)C=C2P(C1=CC=CC=C1)C1=CC=CC=C1
【MOL File】
[RH COD (R)-PHANEPHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:11.4353
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
[RH COD (R)-PHANEPHOS] O3SCF3.cml