71381-08-3
1-METHYL-9-OXO-9H-INDENO(2,1-B)PYRIDINIUM IODIDE
Name1-METHYL-9-OXO-9H-INDENO(2,1-B)PYRIDINIUM IODIDE
1Identification
【Name】
1-METHYL-9-OXO-9H-INDENO(2,1-B)PYRIDINIUM IODIDE
【CAS】
【MDL】
MFCD00453943
【English Synonyms】
【Formula】
C13 H10 N O . I
【MolWeight】
323.128
【Inchi】
InChI=1S/C13H10NO.HI/c1-14-8-4-7-10-9-5-2-3-6-11(9)13(15)12(10)14;/h2-8H,1H3;1H/q+1;/p-1
【InChIKey】
InChIKey=YGNVBQZGXFUOCQ-UHFFFAOYSA-M
【SMILES】
C[n+]1cccc-2c1C(=O)c3c2cccc3.[I-]
【MOL File】
1-METHYL-9-OXO-9H-IN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:2
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-METHYL-9-OXO-9H-INDENO(2,1-B)PYRIDINIUM IODIDE.cml