AG000KDU

123333-70-0 | Sodium 4-Aminobenzenesulfonate Hydrate

AG000KDU

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CAS Number	123333-70-0
Catalog Number	AG000KDU(AGN-PC-0475KR)
Chemical Name	Sodium 4-Aminobenzenesulfonate Hydrate
IUPAC Name	sodium;4-aminobenzenesulfonate;hydrate
InChI	InChI=1S/C6H7NO3S.Na.H2O/c7-5-1-3-6(4-2-5)11(8,9)10;;/h1-4H,7H2,(H,8,9,10);;1H2/q;+1;/p-1
InChI Key	VDGKZGAQOPUDQL-UHFFFAOYSA-M
MDL Number	MFCD00151042
Molecular Formula	C6H8NNaO4S
Molecular Weight	213.1868
SMILES	O=S(C1=CC=C(N)C=C1)([O-])=O.[H]O[H].[Na+]
Synonyms	123333-70-0, Sodium 4-Aminobenzenesulfonate Hydrate, SodiuM Sulfanilate Hydrate, 4-Aminobenzenesulfonic acid, sodium salt hydrate, 1355342-86-7, Sulfanilic acid sodium salt hydrate, Sodium 4-aminobenzenesulfonate hydrate(1:1:x), ACMC-209aoo, C6H6NSO3.Na.H2O, SCHEMBL4384703, Sodium sulfanilate hydrate, 97%, KS-000009VV, Sodium4-AminobenzenesulfonateHydrate, 7658AF, ANW-18118, MFCD00151043, AKOS022186700, TRA0084031, SY014166, AX8283926, TC-106863, MFCD00151043 (97+%),

Complexity	215
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	3
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.007g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	213.183g/mol
Monoisotopic Mass	213.007g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	92.6A^2
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

Certificate of Analysis

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