5612-44-2 Purity
98%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula of IR-786 iodide is C32H36ClIN2.
The synonyms for IR-786 iodide are IR-786, 2-(2-(2-Chloro-3-(2-(1,3,3-trimethylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1,3,3-trimethyl-3H-indol-1-ium iodide, and 2-[2-[2-chloro-3-[(1,3-dihydro-1,3,3-trimethyl-2 h-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-1,3,3-trimethylindolium iodide.
The molecular weight of IR-786 iodide is 611.0 g/mol.
The parent compound of IR-786 iodide is not specified in the reference.
The IUPAC name of IR-786 iodide is (2Z)-2-[(2E)-2-[2-chloro-3-[(E)-2-(1,3,3-trimethylindol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,3,3-trimethylindole; iodide.
The InChI of IR-786 iodide is InChI=1S/C32H36ClN2.HI/c1-31(2)24-14-7-9-16-26(24)34(5)28(31)20-18-22-12-11-13-23(30(22)33)19-21-29-32(3,4)25-15-8-10-17-27(25)35(29)6;/h7-10,14-21H,11-13H2,1-6H3;1H/q+1;/p-1.
The InChIKey of IR-786 iodide is UOKPQDRVXJDDCA-UHFFFAOYSA-M.
The CAS number of IR-786 iodide is 56289-67-9.
The hydrogen bond donor count of IR-786 iodide is 0.
The hydrogen bond acceptor count of IR-786 iodide is 2.