102207-25-0
1-(2-(N-(CYCLOHEXYLMETHYL)-P-ANISIDINO)ETHYL)-1-METHYLPIPERIDINIUM BROMIDE
Name1-(2-(N-(CYCLOHEXYLMETHYL)-P-ANISIDINO)ETHYL)-1-METHYLPIPERIDINIUM BROMIDE
pro_formulaC22 H37 N2 O . Br
1Identification
【Name】
1-(2-(N-(CYCLOHEXYLMETHYL)-P-ANISIDINO)ETHYL)-1-METHYLPIPERIDINIUM BROMIDE
【CAS】
【MDL】
MFCD01699950
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C22 H37 N2 O . Br
【pro_molWeight】
425.451
【Inchi】
InChI=1S/C22H37N2O.BrH/c1-24(16-7-4-8-17-24)18-15-23(19-20-9-5-3-6-10-20)21-11-13-22(25-2)14-12-21;/h11-14,20H,3-10,15-19H2,1-2H3;1H/q+1;/p-1
【InChIKey】
InChIKey=XFAFSVMYJOKOHS-UHFFFAOYSA-M
【SMILES】
C[N+]1(CCCCC1)CCN(CC2CCCCC2)c3ccc(cc3)OC.[Br-]
【MOL File】
1-(2-(N-(CYCLOHEXYLM….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-(2-(N-(CYCLOHEXYLMETHYL)-P-ANISIDINO)ETHYL)-1-METHYLPIPERIDINIUM BROMIDE.cml