137525-61-2
N-(4-METHOXY-4-OXOBUTYL)-N,N-DIMETHYL-1-DODECANAMINIUM IODIDE
NameN-(4-METHOXY-4-OXOBUTYL)-N,N-DIMETHYL-1-DODECANAMINIUM IODIDE
1Identification
【Name】
N-(4-METHOXY-4-OXOBUTYL)-N,N-DIMETHYL-1-DODECANAMINIUM IODIDE
【CAS】
【MDL】
MFCD01103048
【English Synonyms】
【Formula】
C19 H40 N O2 . I
【MolWeight】
441.43
【Inchi】
InChI=1S/C19H40NO2.HI/c1-5-6-7-8-9-10-11-12-13-14-17-20(2,3)18-15-16-19(21)22-4;/h5-18H2,1-4H3;1H/q+1;/p-1
【InChIKey】
InChIKey=LYGBTIGITYLSAP-UHFFFAOYSA-M
【SMILES】
CCCCCCCCCCCC[N+](C)(C)CCCC(=O)OC.[I-]
【MOL File】
N-(4-METHOXY-4-OXOBU….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-(4-METHOXY-4-OXOBUTYL)-N,N-DIMETHYL-1-DODECANAMINIUM IODIDE.cml