AG003FCN

6385-58-6 | 2,2-THIOBIS(4,6-DICHLOROPHENOL) DISODIUM SALT

AG003FCN

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CAS Number	6385-58-6
Catalog Number	AG003FCN(AGN-PC-0TABW0)
Chemical Name	2,2-THIOBIS(4,6-DICHLOROPHENOL) DISODIUM SALT
IUPAC Name	disodium;2,4-dichloro-6-(3,5-dichloro-2-oxidophenyl)sulfanylphenolate
InChI	InChI=1S/C12H6Cl4O2S.2Na/c13-5-1-7(15)11(17)9(3-5)19-10-4-6(14)2-8(16)12(10)18;;/h1-4,17-18H;;/q;2*+1/p-2
InChI Key	FNYZFZRGBBCWBI-UHFFFAOYSA-L
MDL Number	MFCD00058975
Molecular Formula	C12H4Cl4Na2O2S
Molecular Weight	400.0155
SMILES	[O-]C1=C(Cl)C=C(Cl)C=C1SC2=CC(Cl)=CC(Cl)=C2[O-].[Na+].[Na+]
UNII	66V0139H9A
Synonyms	bithionolate sodium, Sodium bithionolate, 6385-58-6, Vancide BN, 2,2'-Thiobis(4,6-dichlorophenol) disodium salt, Natrii bithionolas, Caswell No. 408, Bithionol, sodium salt, Sodium bitionolate, Bithionolate Sodium [USAN], Natrii bitionolas [INN-Latin], UNII-66V0139H9A, Bitionolato sodico [INN-Spanish], Bitionolate de sodium [INN-French], EPA Pesticide Chemical Code 064203, Phenol, 2,2'-thiobis(4,6-dichloro-, disodium salt, Thiobis(4,6-dichlorophenol sodium salt), AI3-26653, Disodium 2,2'-thiobis(4,6-dichlorophenate), Sodium 6,6'-thiobis(2,4-dichlorophenolate), Disodium 2,2'-thiobis(4,6-dichlorophenoxide), 66V0139H9A, Bithionate sodium, Sodium, (2,2'-thiobis(4,6-dichloro-o-phenylene)oxy)di-, Sodium bithonolate disodium 2,2'-thiobis(4,6-dichlorophenoxide), Sodium bitionolate (INN), Sodium bitionolate [INN], 2,2'-thiobis(4,6-dichlorophenol)disodium salt, disodium 2,2'-thiobis(4,6-dichlorophenolate), Bithionolate sodium (USAN), Natrii bitionolas, Bitionolato sodico, Bitionolate de sodium, Bithionol Disodium Salt, DSSTox_CID_1270, DSSTox_RID_76049, DSSTox_GSID_21270, SCHEMBL636173, SPECTRUM1500148, AC1L2L99, CHEMBL1447476, DTXSID8021270, HMS1920I03, HMS2091O05, Tox21_202791, CCG-39711, MFCD00058975, LS-7700, NCGC00094603-01, NCGC00094603-02, NCGC00260337-01, CAS-6385-58-6, FT-0708482, D03135, disodium 2,2'-thiobis(4,6-dichlorobenzenolate), Bis(3,5-dichloro-2-hydroxyphenyl) Sulfide Disodium Salt, I14-102146, 2,2'-Thiobis(4,6-dichlorophenol) disodium salt, AldrichCPR, disodium 2,4-dichloro-6-(3,5-dichloro-2-oxidophenyl)sulfanylphenolate, bithionol, C12H4Cl4Na2O2S, C12-H4-Cl4-O2-S.2Na, CID22882, T0406, Phenol, 2,2'-thiobis[4,6-dichloro-, disodium salt,

Complexity	282
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	399.845g/mol
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	400.002g/mol
Monoisotopic Mass	397.848g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	71.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	9
Hazard statements	H302
Packing Group	Ⅲ
Precautionary statements	P264-P270-P301+P312+P330-P501
UN Code	UN 3077

Certificate of Analysis

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