22317-62-0
1-(2-(2-(P-(ALPHA-METHYLBENZYL)PHENOXY)ETHOXY)ETHYL)PYRIDINIUM CHLORIDE
Name1-(2-(2-(P-(ALPHA-METHYLBENZYL)PHENOXY)ETHOXY)ETHYL)PYRIDINIUM CHLORIDE
1Identification
【Name】
1-(2-(2-(P-(ALPHA-METHYLBENZYL)PHENOXY)ETHOXY)ETHYL)PYRIDINIUM CHLORIDE
【CAS】
【MDL】
MFCD01691015
【English Synonyms】
【Formula】
C23 H26 N O2 . Cl
【MolWeight】
383.916
【Inchi】
InChI=1S/C23H26NO2.ClH/c1-20(21-8-4-2-5-9-21)22-10-12-23(13-11-22)26-19-18-25-17-16-24-14-6-3-7-15-24;/h2-15,20H,16-19H2,1H3;1H/q+1;/p-1
【InChIKey】
InChIKey=QBLNDMJMOXVIDP-UHFFFAOYSA-M
【SMILES】
CC(c1ccccc1)c2ccc(cc2)OCCOCC[n+]3ccccc3.[Cl-]
【MOL File】
1-(2-(2-(P-(ALPHA-ME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-(2-(2-(P-(ALPHA-METHYLBENZYL)PHENOXY)ETHOXY)ETHYL)PYRIDINIUM CHLORIDE.cml