102584-73-6
3-HYDROXY-3-PHENYL-1,1,4-TRIMETHYLPYRROLIDINIUM IODIDE PROPIONATE
Name3-HYDROXY-3-PHENYL-1,1,4-TRIMETHYLPYRROLIDINIUM IODIDE PROPIONATE
1Identification
【Name】
3-HYDROXY-3-PHENYL-1,1,4-TRIMETHYLPYRROLIDINIUM IODIDE PROPIONATE
【CAS】
【MDL】
MFCD01687523
【English Synonyms】
【Formula】
C16 H24 N O2 . I
【MolWeight】
389.271
【Inchi】
InChI=1S/C16H24NO2.HI/c1-5-15(18)19-16(14-9-7-6-8-10-14)12-17(3,4)11-13(16)2;/h6-10,13H,5,11-12H2,1-4H3;1H/q+1;/p-1
【InChIKey】
InChIKey=URTRVFGAFPCMKW-UHFFFAOYSA-M
【SMILES】
CCC(=O)OC1(C[N+](CC1C)(C)C)c2ccccc2.[I-]
【MOL File】
3-HYDROXY-3-PHENYL-1….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:3
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-HYDROXY-3-PHENYL-1,1,4-TRIMETHYLPYRROLIDINIUM IODIDE PROPIONATE.cml