70615-81-5
(5-METHYLSULFANYL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE
Name(5-METHYLSULFANYL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE
pro_formulaC28 H23 N O P S . I
1Identification
【Name】
(5-METHYLSULFANYL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE
【CAS】
【MDL】
MFCD00181190
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C28 H23 N O P S . I
【pro_molWeight】
579.436
【Inchi】
InChI=1S/C28H23NOPS.HI/c1-32-28-27(29-26(30-28)22-14-6-2-7-15-22)31(23-16-8-3-9-17-23,24-18-10-4-11-19-24)25-20-12-5-13-21-25;/h2-21H,1H3;1H/q+1;/p-1
【InChIKey】
InChIKey=AZVWBBMEVMSBQB-UHFFFAOYSA-M
【SMILES】
CSc1c(nc(o1)c2ccccc2)[P+](c3ccccc3)(c4ccccc4)c5ccccc5.[I-]
【MOL File】
(5-METHYLSULFANYL-2-….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:2
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(5-METHYLSULFANYL-2-PHENYL-OXAZOL-4-YL)-TRIPHENYL-PHOSPHONIUM, IODIDE.cml