Input interpretation
(4-benzoylbenzyl)trimethylammonium chloride
Chemical names and formulas
formula | C_6H_5COC_6H_4CH_2N(CH_3)_3Cl Hill formula | C_17H_20ClNO name | (4-benzoylbenzyl)trimethylammonium chloride IUPAC name | (4-benzoylphenyl)methyl-trimethylammonium chloride alternate names | (4-benzoylphenyl)methyl-trimethyl-ammonium chloride mass fractions | C (carbon) 70.5% | Cl (chlorine) 12.2% | H (hydrogen) 6.96% | N (nitrogen) 4.83% | O (oxygen) 5.52%
Structure diagram
Structure diagram
vertex count | 20 edge count | 20 Schultz index | 3242 Wiener index | 776 Hosoya index | 6376 Balaban index | 1.755
Basic properties
molar mass | 289.8 g/mol phase | solid (at STP) melting point | 205 °C
Units
Chemical identifiers
(C)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2.[Cl-] InChI identifier | InChI=1/C17H20NO.ClH/c1-18(2, 3)13-14-9-11-16(12-10-14)17(19)15-7-5-4-6-8-15;/h4-12H, 13H2, 1-3H3;1H/q+1;/p-1/fC17H20NO.Cl/h;1h/qm;-1 MDL number | MFCD00055646](../image_source/59231eb4243a144c6d15c8b031d07581.png)
CAS number | 78697-25-3 PubChem CID number | 174155 SMILES identifier | C[N+](C)(C)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2.[Cl-] InChI identifier | InChI=1/C17H20NO.ClH/c1-18(2, 3)13-14-9-11-16(12-10-14)17(19)15-7-5-4-6-8-15;/h4-12H, 13H2, 1-3H3;1H/q+1;/p-1/fC17H20NO.Cl/h;1h/qm;-1 MDL number | MFCD00055646