101015-22-9
(4-METHYL-M-PHENYLENEBIS(IMINOCARBONYLMETHYLENE))BIS(DIETHYLMETHYLAMMONIUM IODIDE)
Name(4-METHYL-M-PHENYLENEBIS(IMINOCARBONYLMETHYLENE))BIS(DIETHYLMETHYLAMMONIUM IODIDE)
pro_formulaC21 H38 N4 O2 . 2 I
1Identification
【Name】
(4-METHYL-M-PHENYLENEBIS(IMINOCARBONYLMETHYLENE))BIS(DIETHYLMETHYLAMMONIUM IODIDE)
【CAS】
【MDL】
MFCD01669552
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C21 H38 N4 O2 . 2 I
【pro_molWeight】
632.357
【Inchi】
InChI=1S/C21H36N4O2.2HI/c1-8-24(6,9-2)15-20(26)22-18-12-17(5)13-19(14-18)23-21(27)16-25(7,10-3)11-4;;/h12-14H,8-11,15-16H2,1-7H3;2*1H
【InChIKey】
InChIKey=KANJDXSTUDYJKM-UHFFFAOYSA-N
【SMILES】
CC[N+](C)(CC)CC(=O)Nc1cc(cc(c1)NC(=O)C[N+](C)(CC)CC)C.[I-].[I-]
【MOL File】
(4-METHYL-M-PHENYLEN….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:2.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(4-METHYL-M-PHENYLENEBIS(IMINOCARBONYLMETHYLENE))BIS(DIETHYLMETHYLAMMONIUM IODIDE).cml