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1-(3-Sulfopropyl)-2-vinylpyridinium Hydroxide Inner Salt - ≥98%, high purity , CAS No.6613-64-5

COA

Grade & Purity:

≥98%

Cas Number: 6613-64-5
Molecular Weight: 227.28
MDL number: MFCD00080643
PubChem CID: 81089
PubChem SID: 488185925

In stock

Item Number

S304310

Grouped product items
SKU	Size	Availability	Price
S304310-5g	5g	5	$16.90
S304310-25g	25g	1	$59.90
S304310-100g	100g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$199.90

View related series

Halogen free heterocyclic block (1207) Pyridines (1259)

Basic Description

Synonyms	DTXSID60216327 \| 1-(3-Sulfopropyl)-2-vinylpyridinium hydroxide inner salt \| FT-0707242 \| SCHEMBL18148998 \| 1-(3-Sulfonatopropyl)-2-vinylpyridinium \| 1-(3-Sulfopropyl-1)-2-vinyl pyridinium betaine \| 1-(3-Sulphonatopropyl)-2-vinylpyridinium \| 3-(2-ethenylpy
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Argon charged,Desiccated
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Pyridinium derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Pyridinium derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Pyridinium derivatives
Alternative Parents	Sulfonyls Organosulfonic acids Heteroaromatic compounds Alkanesulfonic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic zwitterions Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Pyridinium - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Heteroaromatic compound - Azacycle - Organic zwitterion - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as pyridinium derivatives. These are compounds containing a pyridinium ring, which is the cationic form of pyridine.
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	488185925
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488185925
IUPAC Name	3-(2-ethenylpyridin-1-ium-1-yl)propane-1-sulfonate
INCHI	InChI=1S/C10H13NO3S/c1-2-10-6-3-4-7-11(10)8-5-9-15(12,13)14/h2-4,6-7H,1,5,8-9H2
InChIKey	DNHDSWZXBHTLDP-UHFFFAOYSA-N
Smiles	C=CC1=CC=CC=[N+]1CCCS(=O)(=O)[O-]
Isomeric SMILES	C=CC1=CC=CC=[N+]1CCCS(=O)(=O)[O-]
PubChem CID	81089
Molecular Weight	227.28

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

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

10 results found

Lot Number	Certificate Type	Date	Item
B2518550	Certificate of Analysis	Dec 19, 2024	S304310
B2518551	Certificate of Analysis	Dec 19, 2024	S304310
B2518552	Certificate of Analysis	Dec 19, 2024	S304310
B2525496	Certificate of Analysis	Dec 19, 2024	S304310
G23131238	Certificate of Analysis	Jul 06, 2023	S304310
G23131321	Certificate of Analysis	Jul 06, 2023	S304310
G23131325	Certificate of Analysis	Jul 06, 2023	S304310
G23131323	Certificate of Analysis	Jul 06, 2023	S304310
G23131260	Certificate of Analysis	Jul 06, 2023	S304310
K2429092	Certificate of Analysis	Jul 06, 2023	S304310

Chemical and Physical Properties

Solubility	Soluble in water
Sensitivity	Hygroscopic
Melt Point(°C)	263°C(lit.)
Molecular Weight	227.280 g/mol
XLogP3	0.900
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	227.062 Da
Monoisotopic Mass	227.062 Da
Topological Polar Surface Area	69.500 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	281.000
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	1

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