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N-{[4-[2-(Formylamino)acetyl]-5-hydroxy-2-phenoxyphenyl}methanesulfonamide - ≥99%, high purity , CAS No.149457-03-4

COA

Grade & Purity:

≥99%

Cas Number: 149457-03-4
PubChem CID: 10546715

In stock

Item Number

N769066

Grouped product items
SKU	Size	Availability	Price
N769066-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$110.90
N769066-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$334.90
N769066-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,161.90
N769066-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,466.90

Basic Description

Specifications & Purity	≥99%
Storage Temp	Store at 2-8°C
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 Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Diphenylethers

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Diphenylethers
Intermediate Tree Nodes	Not available
Direct Parent	Diphenylethers
Alternative Parents	Alkyl-phenylketones Diarylethers Sulfanilides Aryl alkyl ketones Benzoyl derivatives Phenol ethers Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Organic sulfonamides Organosulfonamides Vinylogous acids Aminosulfonyl compounds Secondary carboxylic acid amides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Diphenylether - Alkyl-phenylketone - Diaryl ether - Sulfanilide - Phenylketone - Phenol ether - Benzoyl - Aryl ketone - Aryl alkyl ketone - Phenoxy compound - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Organosulfonic acid amide - Organic sulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Vinylogous acid - Ketone - Secondary carboxylic acid amide - Carboxamide group - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
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	N-[2-[2-hydroxy-4-(methanesulfonamido)-5-phenoxyphenyl]-2-oxoethyl]formamide
INCHI	InChI=1S/C16H16N2O6S/c1-25(22,23)18-13-8-14(20)12(15(21)9-17-10-19)7-16(13)24-11-5-3-2-4-6-11/h2-8,10,18,20H,9H2,1H3,(H,17,19)
InChIKey	BTXBRUSJXFSAJA-UHFFFAOYSA-N
Smiles	CS(=O)(=O)NC1=C(C=C(C(=C1)O)C(=O)CNC=O)OC2=CC=CC=C2
Isomeric SMILES	CS(=O)(=O)NC1=C(C=C(C(=C1)O)C(=O)CNC=O)OC2=CC=CC=C2
Alternate CAS	149457-03-4
PubChem CID	10546715

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	364.400 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	7
Exact Mass	364.073 Da
Monoisotopic Mass	364.073 Da
Topological Polar Surface Area	130.000 Å²
Heavy Atom Count	25
Formal Charge	0
Complexity	555.000
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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