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Isoxicam - 10mM in DMSO, high purity , CAS No.34552-84-6

COA

Grade & Purity:

10mM in DMSO

Cas Number: 34552-84-6
Molecular Weight: 335.34
PubChem CID: 54677972

In stock

Item Number

I423520

Grouped product items
SKU	Size	Availability	Price	Qty
I423520-1ml	1ml	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$101.90

a nonsteroidal anti-inflammatory

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Compound libraries (12325)

Basic Description

Synonyms	isoxicam \| 34552-84-6 \| Maxicam \| Isoxicamum \| Isoxicamo \| W 8495 \| EINECS 252-084-5 \| UNII-8XU734C4NG \| BRN 0577221 \| CHEBI:76163 \| NSC-758436 \| 8XU734C4NG \| DTXSID0045462 \| W-8495 \| 2H-1,2-Benzothiazine-3-carboxamide, 4-hydroxy-2-methyl-N-(5-methyl-3-isoxazolyl)-, 1,1-dioxide \| 4-Hy
Specifications & Purity	10mM in DMSO
Storage Temp	Store at -80°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Isoxicam is a potent, orally active, nonsteroidal anti-inflammatory drug.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzothiazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzothiazines
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzothiazines
Alternative Parents	Alpha amino acids and derivatives Organosulfonamides Benzenoids 1,2-thiazines Vinylogous acids Isoxazoles Heteroaromatic compounds N-acylimines Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Alpha-amino acid or derivatives - Benzothiazine - Ortho-thiazine - Organosulfonic acid amide - Benzenoid - Azole - Isoxazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous acid - Heteroaromatic compound - N-acylimine - Carboxylic acid derivative - Azacycle - Oxacycle - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organopnictogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzothiazines. These are organic compounds containing a benzene fused to a thiazine ring (a six-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors	monocarboxylic acid amide - isoxazoles - benzothiazine
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	4-hydroxy-2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-1,1-dioxo-1λ6,2-benzothiazine-3-carboxamide
INCHI	InChI=1S/C14H13N3O5S/c1-8-7-11(16-22-8)15-14(19)12-13(18)9-5-3-4-6-10(9)23(20,21)17(12)2/h3-7,18H,1-2H3,(H,15,16,19)
InChIKey	YYUAYBYLJSNDCX-UHFFFAOYSA-N
Smiles	CC1=CC(=NO1)NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)O
Isomeric SMILES	CC1=CC(=NO1)NC(=O)C2=C(C3=CC=CC=C3S(=O)(=O)N2C)O
Molecular Weight	335.34
Reaxy-Rn	577221
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=577221&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Melt Point(°C)	>240ºC
Molecular Weight	335.340 g/mol
XLogP3	3.000
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	2
Exact Mass	335.058 Da
Monoisotopic Mass	335.058 Da
Topological Polar Surface Area	121.000 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	627.000
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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