AG003AG2

14278-60-5 | Benzenesulfonic acid, 3-hydroxy-, monosodium salt

AG003AG2

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CAS Number	14278-60-5
Catalog Number	AG003AG2(AGN-PC-0PSZF4)
Chemical Name	Benzenesulfonic acid, 3-hydroxy-, monosodium salt
IUPAC Name	sodium;3-hydroxybenzenesulfonate
InChI	InChI=1S/C6H6O4S.Na/c7-5-2-1-3-6(4-5)11(8,9)10;/h1-4,7H,(H,8,9,10);/q;+1/p-1
InChI Key	SYGMNXFMNIFZLK-UHFFFAOYSA-M
MDL Number	MFCD00464504
Molecular Formula	C6H5NaO4S
Molecular Weight	196.1563
SMILES	O=S(C1=CC=CC(O)=C1)([O-])=O.[Na+]
UNII	YH50NPO23P
Synonyms	sodium 3-hydroxybenzenesulfonate, 14278-60-5, Sodium m-phenolsulfonate, UNII-YH50NPO23P, YH50NPO23P, Benzenesulfonic acid, 3-hydroxy-, monosodium salt, Sodium m-hydroxybenzenesulfonate, Benzenesulfonic acid, m-hydroxy-, monosodium salt, Benzenesulfonic acid, 3-hydroxy-, sodium salt (1:1), SCHEMBL7549107, DTXSID40162176, MFCD00464504, AKOS006343303, OR45082, Y-9978,

Complexity	220
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	195.981g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	196.152g/mol
Monoisotopic Mass	195.981g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	85.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H317
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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