55630-20-1
(5-MORPHOLIN-4-YL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE
Name(5-MORPHOLIN-4-YL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE
FormulaC31 H28 N2 O2 P . I
1Identification
【Name】
(5-MORPHOLIN-4-YL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE
【CAS】
【MDL】
MFCD00181766
【English Synonyms】
【Formula】
C31 H28 N2 O2 P . I
【MolWeight】
618.448
【Inchi】
InChI=1S/C31H28N2O2P.HI/c1-5-13-25(14-6-1)29-32-30(31(35-29)33-21-23-34-24-22-33)36(26-15-7-2-8-16-26,27-17-9-3-10-18-27)28-19-11-4-12-20-28;/h1-20H,21-24H2;1H/q+1;/p-1
【InChIKey】
InChIKey=CVLHDJUXNZAKHV-UHFFFAOYSA-M
【SMILES】
c1ccc(cc1)c2nc(c(o2)N3CCOCC3)[P+](c4ccccc4)(c5ccccc5)c6ccccc6.[I-]
【MOL File】
(5-MORPHOLIN-4-YL-2-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(5-MORPHOLIN-4-YL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE.cml