AG003MAC

69898-45-9 | Sodium 4-(5-phenyl-3-(4-sulfopyridin-2-yl)-1,2,4-triazin-6-yl)benzenesulfonate

AG003MAC

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CAS Number	69898-45-9
Catalog Number	AG003MAC(AGN-PC-0TX7CC)
Chemical Name	Sodium 4-(5-phenyl-3-(4-sulfopyridin-2-yl)-1,2,4-triazin-6-yl)benzenesulfonate
IUPAC Name	sodium;4-[3-pyridin-2-yl-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonate
InChI	InChI=1S/C20H14N4O6S2.Na/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);/q;+1/p-1
InChI Key	ZGVNYCXXBQPDPQ-UHFFFAOYSA-M
MDL Number	MFCD00078417
Molecular Formula	C20H13N4NaO6S2
Molecular Weight	492.4602
SMILES	C1(=CC=CC=C1)C=1N=C(N=NC1C1=CC=C(C=C1)S(=O)(=O)[O-])C1=NC=CC(=C1)S(=O)(=O)O.[Na+]
Synonyms	Ferrozine, Ferrozine, Monosodium Salt, Ferrozine, Monosodium Salt, Monohydrate, Monosodium Salt Ferrozine, FERROZINE, 69898-45-9, PDT disulfonate, Ferrozine monosodium salt, Ferrozine sodium, Ferrozine sodium salt, 3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine-4',4''-disulfonic acid sodium salt, F-0970, P-8310, 3-(2-pyridyl)-5,6-bis(4-phenylsulfonic acid)-1,2,4-triazine, 5,6-Diphenyl-3-(2-pyridyl)-1,2,4-triazine-4',4''-disulfonic acid sodium salt, 3-(2-Pyridyl)-5,6-bis(4-sulfophenyl)-1,2,4-triazine, monosodium salt, EINECS 274-196-3, Sodium (3-(pyridin-2-yl)-1,2,4-triazine-5,6-diyl)bis(benzene-4,4'-sulphonate), C20H13N4NaO6S2, MFCD00078417, AKOS024371032, Benzenesulfonic acid, 4,4'-(3-(2-pyridinyl)-1,2,4-triazine-5,6-diyl)bis-, monosodium salt, Benzenesulfonic acid, 4,4'-(3-(2-pyridinyl)-1,2,4-triazine-5,6-diyl)bis-, sodium salt (1:1), SC-52689, U205, FT-0613590, ST51007223, J3.622.599H, A-8658, A836688, Q27132924, 3-(2-Pyridyl)-5,6-bis(4-phenylsulfonic acid)-1,2,4-triazine monosodium salt, 3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine-4',4''-disulfonic acid sodium salt, BioXtra, 4-[3-(2-pyridyl)-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonic acid, so dium salt, 4-[3-(2-Pyridyl)-6-[4-(sodiosulfo)phenyl]-1,2,4-triazine-5-yl]benzenesulfonic acid, 5,6-Diphenyl-3-(2-pyridyl)-1,2,4-triazine-4,4-disulfonic acid sodium salt, sodium 4-(3-(pyridin-2-yl)-6-(4-sulfophenyl)-1,2,4-triazin-5-yl)benzenesulfonate, sodium 4-[3-(2-pyridinyl)-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonate, sodium 4-[3-pyridin-2-yl-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonate, sodium;4-[3-pyridin-2-yl-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonate, 3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine-4',4''-disulfonic acid sodium salt, for spectrophotometric det. of Fe, >=97.0%, 3-(2-Pyridyl)-5,6-diphenyl-1,2,4-triazine-4',4''-disulfonic acid sodium salt, Indicator ligand, Ferrozine mono-sodium salt [ 3-(2-Pyridyl)-5,6-bis(4-sulfophenyl)-1,2,4-triazine, monosodium salt ], AC1Q1VHM, C20H14N4O6S2.Na, Ferrozine mono-sodium salt hydrate, PDT paragraph signthorn>>CEao yen, AR-1K6035, CID135462, C20-H14-N4-O6-S2.Na, Sodium3- -1,2,4-triazine-5,6-diyl]bis hydrate, Benzenesulfonic acid, 4,4'-[3-(2-pyridinyl)-1,2,4-triazine-5,6-diyl]bis-, monosodium salt, natrium-4-[3-(pyridin-2-yl)-5-(4-sulfophenyl)-1,2,4-triazin-6-yl]benzolsulfonat, Benzenesulfonic acid, 4,4'-[3-(2-pyridinyl)-1,2,4-triazine-5,6-diyl]bis-, sodium salt (1:1), 5,6-Diphenyl-3(2-pyridyl)-1,2,4-triazine-4',4''-disulfonic acid monosodium salt, BENZENESULFONIC ACID, 4,4'-[3-(2-PYRIDNYL)-1,2,4-TRIAZINE-5,6-DIYL]BIS-, potassium 4-[3-(pyridin-2-yl)-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonate, Sodium 3-(pyridin-2-yl)-1,2,4-triazine-5,6-diyl]bis(benzene-4,4'-sulphonate), sodium 4-[3-(pyridin-2-yl)-6-(4-sulfophenyl)-1,2,4-triazin-5-yl]benzenesulfonate, 38767-72-5, 5,6- paragraph signthorn+/-(1/2)>>u-3-(2-ssAa currency>>u)-1,2,4-Eya masculine-4 inverted exclamation marka,4 inverted exclamation marka- paragraph signthorn>>CEa AAENI, Benzenesulfonic acid, 4,4'-[3-(2-pyridinyl)-1,2, 4-triazine-5,6-diyl]bis-, monosodium salt,

Complexity	834
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	492.017421g/mol
Formal Charge	0
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	492.5g/mol
Monoisotopic Mass	492.017421g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	180Ų
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

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