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5-Methylsulfonyltetrazole , CAS No.21744-55-8

COA

Cas Number: 21744-55-8
Molecular Weight: 148.14
PubChem CID: 4770986

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Item Number

M168647

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SKU	Size	Availability	Price	Qty
M168647-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$920.90

Discover 5-Methylsulfonyltetrazole by Aladdin Scientific in for only $920.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	5-Methylsulfonyltetrazole \| 21744-55-8 \| 5-(methylsulfonyl)-1H-tetrazole \| 5-methylsulfonyl-2H-tetrazole \| 5-methanesulfonyl-1H-1,2,3,4-tetrazole \| MFCD07432800 \| SCHEMBL2199714 \| DTXSID10406397 \| IURGLLWWASFDGT-UHFFFAOYSA-N \| WAA74455 \| STK667583 \| AKOS000297150 \| AS-43199 \| SY31
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Tetrazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Tetrazoles
Intermediate Tree Nodes	Not available
Direct Parent	Tetrazoles
Alternative Parents	Sulfones Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Heteroaromatic compound - Tetrazole - Sulfonyl - Sulfone - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as tetrazoles. These are organic compounds containing a tetrazole ring, which is a five-member aromatic heterocycle made up of four nitrogen atoms and a one carbon atom.
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

IUPAC Name	5-methylsulfonyl-2H-tetrazole
INCHI	InChI=1S/C2H4N4O2S/c1-9(7,8)2-3-5-6-4-2/h1H3,(H,3,4,5,6)
InChIKey	IURGLLWWASFDGT-UHFFFAOYSA-N
Smiles	CS(=O)(=O)C1=NNN=N1
Isomeric SMILES	CS(=O)(=O)C1=NNN=N1
PubChem CID	4770986
Molecular Weight	148.14

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	148.150 g/mol
XLogP3	-1.000
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	148.005 Da
Monoisotopic Mass	148.005 Da
Topological Polar Surface Area	97.000 Å²
Heavy Atom Count	9
Formal Charge	0
Complexity	181.000
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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