64872-13-5
2-[4-(DIMETHYLAMINO)STYRYL]-N-METHYLBENZOXAZOLIUM PERCHLORATE
Name2-[4-(DIMETHYLAMINO)STYRYL]-N-METHYLBENZOXAZOLIUM PERCHLORATE
FormulaC18 H19 N2 O . Cl O4
1Identification
【Name】
2-[4-(DIMETHYLAMINO)STYRYL]-N-METHYLBENZOXAZOLIUM PERCHLORATE
【CAS】
【MDL】
MFCD00274415
【English Synonyms】
【Formula】
C18 H19 N2 O . Cl O4
【MolWeight】
378.81
【Inchi】
InChI=1S/C18H19N2O.ClHO4/c1-19(2)15-9-5-4-8-14(15)12-13-18-20(3)16-10-6-7-11-17(16)21-18;2-1(3,4)5/h4-13H,1-3H3;(H,2,3,4,5)/q+1;/p-1
【InChIKey】
InChIKey=HIPNQJWOBIMJQM-UHFFFAOYSA-M
【SMILES】
C[n+]1c2ccccc2oc1/C=C/c3ccccc3N(C)C.[O-]Cl(=O)(=O)=O
【MOL File】
2-[4-(DIMETHYLAMINO)….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
2-[4-(DIMETHYLAMINO)STYRYL]-N-METHYLBENZOXAZOLIUM PERCHLORATE.cml