210169-40-7
(S)-(+)-5,5'-BIS[DI(3,5-DI-T-BUTYL-4-METHOXYPHENYL)PHOSPHINO]-4,4'-BI-1,3-BENZODIOXOLE
Name(S)-(+)-5,5'-BIS[DI(3,5-DI-T-BUTYL-4-METHOXYPHENYL)PHOSPHINO]-4,4'-BI-1,3-BENZODIOXOLE
1Identification
【Name】
(S)-(+)-5,5'-BIS[DI(3,5-DI-T-BUTYL-4-METHOXYPHENYL)PHOSPHINO]-4,4'-BI-1,3-BENZODIOXOLE
【CAS】
【MDL】
MFCD09753003
【English Synonyms】
【Formula】
C74 H100 O8 P2
【MolWeight】
1179.54
【Inchi】
InChI=1S/C74H100O8P2/c1-67(2,3)47-33-43(34-48(61(47)75-25)68(4,5)6)83(44-35-49(69(7,8)9)62(76-26)50(36-44)70(10,11)12)57-31-29-55-65(81-41-79-55)59(57)60-58(32-30-56-66(60)82-42-80-56)84(45-37-51(71(13,14)15)63(77-27)52(38-45)72(16,17)18)46-39-53(73(19,20)21)64(78-28)54(40-46)74(22,23)24/h29-40H,41-42H2,1-28H3
【InChIKey】
InChIKey=ZNORAFJUESSLTM-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1cc(cc(c1OC)C(C)(C)C)P(c2ccc3c(c2c4c(ccc5c4OCO5)P(c6cc(c(c(c6)C(C)(C)C)OC)C(C)(C)C)c7cc(c(c(c7)C(C)(C)C)OC)C(C)(C)C)OCO3)c8cc(c(c(c8)C(C)(C)C)OC)C(C)(C)C
【MOL File】
(S)-(+)-5,5'-BIS[DI(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:8
XLogP3:25.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
【WGK Germany】
3
4CML File
(S)-(+)-5,5'-BIS[DI(3,5-DI-T-BUTYL-4-METHOXYPHENYL)PHOSPHINO]-4,4'-BI-1,3-BENZODIOXOLE.cml