Einecs 267-551-9

methyl sulfate;2-(4-methyl-1,2,4-triazol-4-ium-1-yl)benzo[f]chromen-3-one

Also Known As: EINECS 267-551-9|4-Methyl-1-(3-oxo-3H-naphtho(2,1-b)pyran-2-yl)-1H-1,2,4-triazoliummethyl sulphate|4-Methyl-1-(3-oxo-3H-benzo[f]chromen-2-yl)-4H-1,2,4-triazol-1-ium methyl sulfate|4-Methyl-1-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)-1H-1,2,4-triazol-4-ium methyl sulfate|4-Methyl-1-(3-oxo-3H-naphtho[2,1-b]pyran-2-yl)-1H-1,2,4-triazolium methyl sulfate|methyl sulfate; 2-(4-methyl-1,2,4-triazol-4-ium-1-yl)benzo[f]chromen-3-one

Molecular Formula	C17H15N3O6S
Molecular Weight	389.06815 g/mol
LogP	1.0494
Topological Polar Surface Area	118.34 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	2
Exact Mass	389.06815
Monoisotopic Mass	389.06815
Heavy Atoms	27
Complexity	1276.8115

Chemical Identifiers

CAS Number	67883-54-9
SMILES	C[N+]1=CN(N=C1)C2=CC3=C(C=CC4=CC=CC=C43)OC2=O.COS(=O)(=O)[O-]