3-(2-PYRIDYL)-5,6-DIPHENYL-1,2,4-TRIAZINE-P,P'-DISULFONIC ACID MONOSODIUM SALT TRIHYDRATE

CAS No.
CCD No.
CCD08021666
Formula
C20 H13 N4 O6 S2 . Na . 3 H2 O
MolWeight
546.511

Basic Information

Product Name: 3-(2-PYRIDYL)-5,6-DIPHENYL-1,2,4-TRIAZINE-P,P'-DISULFONIC ACID MONOSODIUM SALT TRIHYDRATE
English Synonyms: 3-(2-PYRIDYL)-5,6-DIPHENYL-1,2,4-TRIAZINE-P,P'-DISULFONIC ACID MONOSODIUM SALT TRIHYDRATE
MDL Number.: MFCD00150796
H bond acceptor: 10
H bond donor: 1
Smile: c1ccnc(c1)c2nc(c(nn2)c3ccc(cc3)S(=O)(=O)O)c4ccc(cc4)S(=O)(=O)[O-].O.O.O.[Na+]
InChi: InChI=1S/C20H14N4O6S2.Na.3H2O/c25-31(26,27)15-8-4-13(5-9-15)18-19(14-6-10-16(11-7-14)32(28,29)30)23-24-20(22-18)17-3-1-2-12-21-17;;;;/h1-12H,(H,25,26,27)(H,28,29,30);;3*1H2/q;+1;;;/p-1
InChiKey: InChIKey=QNPIWBQTTCXVFC-UHFFFAOYSA-M

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