874013-62-4
BIS[[1-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL]-[2-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL-1-OXIDE]BENZENE]COPPER(I) TRIFLUOROMETHANESULFONATE
NameBIS[[1-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL]-[2-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL-1-OXIDE]BENZENE]COPPER(I) TRIFLUOROMETHANESULFONATE
pro_formula2 C18 H28 O P2 . C F3 O3 S . Cu
1Identification
【Name】
BIS[[1-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL]-[2-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL-1-OXIDE]BENZENE]COPPER(I) TRIFLUOROMETHANESULFONATE
【CAS】
【MDL】
MFCD17018797
【中文同义词】
【EnglishSynonyms】
【pro_formula】
2 C18 H28 O P2 . C F3 O3 S . Cu
【pro_molWeight】
857.346
【Inchi】
InChI=1S/2C18H28OP2.CHF3O3S.Cu/c2*1-13-9-10-14(2)20(13)17-7-5-6-8-18(17)21(19)15(3)11-12-16(21)4;2-1(3,4)8(5,6)7;/h2*5-8,13-16H,9-12H2,1-4H3;(H,5,6,7);/q;;;+1/p-1/t2*13-,14-,15-,16-;;/m11../s1
【InChIKey】
InChIKey=JGVWSKIVCRMXGT-YCIFJGFLSA-M
【SMILES】
C[C@@H]1CC[C@H](P1c2ccccc2P3(=O)[C@@H](CC[C@H]3C)C)C.C[C@@H]1CC[C@H](P1c2ccccc2P3(=O)[C@@H](CC[C@H]3C)C)C.C(F)(F)(F)S(=O)(=O)[O-].[Cu+]
【MOL File】
BIS[[1-(2R,5R)-2,5-D….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:1
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
BIS[[1-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL]-[2-(2R,5R)-2,5-DIMETHYLPHOSPHOLANYL-1-OXIDE]BENZENE]COPPER(I) TRIFLUOROMETHANESULFONATE.cml