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sodium 3-aminobenzenesulfonate - 60% aqueous solution, high purity , CAS No.1126-34-7

COA

Grade & Purity:

60% aqueous solution

Cas Number: 1126-34-7
Molecular Weight: 195.173
PubChem CID: 23669135
PubChem SID: 504769563

In stock

Item Number

M165967

Grouped product items
SKU	Size	Availability	Price	Qty
M165967-100g	100g	3	$35.90
M165967-500g	500g	1	$144.90

Basic Description

Synonyms	sodium 3-aminobenzenesulfonate \| 1126-34-7 \| Metanilic Acid Sodium Salt \| sodium;3-aminobenzenesulfonate \| Metanilic acid, sodium salt \| Benzenesulfonic acid, 3-amino-, monosodium salt \| Sodium 3-aminobenzenesulphonate \| Metanilan sodny \| Metanilan sodny [Czech] \| EINECS 2
Specifications & Purity	60% aqueous solution
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzenesulfonic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzenesulfonic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Benzenesulfonic acids and derivatives
Alternative Parents	Benzenesulfonyl compounds 1-sulfo,2-unsubstituted aromatic compounds Aniline and substituted anilines Sulfonyls Organosulfonic acids Primary amines Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Benzenesulfonate - Arylsulfonic acid or derivatives - Benzenesulfonyl group - 1-sulfo,2-unsubstituted aromatic compound - Aniline or substituted anilines - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Organic alkali metal salt - Organic salt - Organic sodium salt - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Primary amine - Organosulfur compound - Organonitrogen compound - Organic nitrogen compound - Organic zwitterion - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as benzenesulfonic acids and derivatives. These are organic compounds containing a sulfonic acid or a derivative thereof that is linked to a benzene ring.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504769563
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504769563
IUPAC Name	sodium;3-aminobenzenesulfonate
INCHI	InChI=1S/C6H7NO3S.Na/c7-5-2-1-3-6(4-5)11(8,9)10;/h1-4H,7H2,(H,8,9,10);/q;+1/p-1
InChIKey	GLXWXYTYBIBBLD-UHFFFAOYSA-M
Smiles	C1=CC(=CC(=C1)S(=O)(=O)[O-])N.[Na+]
Isomeric SMILES	C1=CC(=CC(=C1)S(=O)(=O)[O-])N.[Na+]
Molecular Weight	195.173
Reaxy-Rn	4772400
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4772400&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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8 results found

Lot Number	Certificate Type	Date	Item
E23261087	Certificate of Analysis	Apr 23, 2023	M165967
E23261096	Certificate of Analysis	Apr 23, 2023	M165967
E23261102	Certificate of Analysis	Apr 23, 2023	M165967
E23261085	Certificate of Analysis	Apr 23, 2023	M165967
A2424279	Certificate of Analysis	Apr 23, 2023	M165967
B2208500	Certificate of Analysis	Jan 05, 2022	M165967
B2208503	Certificate of Analysis	Jan 05, 2022	M165967
B2208484	Certificate of Analysis	Jan 05, 2022	M165967

Chemical and Physical Properties

Molecular Weight	195.170 g/mol
XLogP3
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	194.997 Da
Monoisotopic Mass	194.997 Da
Topological Polar Surface Area	91.600 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	223.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

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