226409-58-1
(N-SUCCINIMIDYLOXYCARBONYL-METHYL)TRIS(2,4,6-TRIMETHOXYPHENYL)PHOSPHONIUM BROMIDE
Name(N-SUCCINIMIDYLOXYCARBONYL-METHYL)TRIS(2,4,6-TRIMETHOXYPHENYL)PHOSPHONIUM BROMIDE
FormulaC33 H39 N O13 P . Br
1Identification
【Name】
(N-SUCCINIMIDYLOXYCARBONYL-METHYL)TRIS(2,4,6-TRIMETHOXYPHENYL)PHOSPHONIUM BROMIDE
【CAS】
【MDL】
MFCD03095505
【English Synonyms】
【Formula】
C33 H39 N O13 P . Br
【MolWeight】
768.543
【Inchi】
InChI=1S/C33H39NO13P.BrH/c1-38-19-12-22(41-4)31(23(13-19)42-5)48(18-30(37)47-34-28(35)10-11-29(34)36,32-24(43-6)14-20(39-2)15-25(32)44-7)33-26(45-8)16-21(40-3)17-27(33)46-9;/h12-17H,10-11,18H2,1-9H3;1H/q+1;/p-1
【InChIKey】
InChIKey=YKMSQZIYVKTUHI-UHFFFAOYSA-M
【SMILES】
COc1cc(c(c(c1)OC)[P+](CC(=O)ON2C(=O)CCC2=O)(c3c(cc(cc3OC)OC)OC)c4c(cc(cc4OC)OC)OC)OC.[Br-]
【MOL File】
(N-SUCCINIMIDYLOXYCA….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:14
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(N-SUCCINIMIDYLOXYCARBONYL-METHYL)TRIS(2,4,6-TRIMETHOXYPHENYL)PHOSPHONIUM BROMIDE.cml