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WAY-300042 - 98%, high purity , CAS No.89607-42-1

COA

Grade & Purity:

≥98%

Cas Number: 89607-42-1
Molecular Weight: 268.276
PubChem CID: 3722212
PubChem SID: 504762689

In stock

Item Number

W416819

Grouped product items
SKU	Size	Availability	Price
W416819-5mg	5mg	6	$320.90
W416819-10mg	10mg	6	$520.90
W416819-25mg	25mg	6	$1,000.90
W416819-50mg	50mg	5	$1,600.90
W416819-100mg	100mg	5	$2,600.90

Basic Description

Specifications & Purity	≥98%
Storage Temp	Store at -20°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	anticancer potency; antimicrobial agents;

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Phenols
    - Subclass 1-hydroxy-4-unsubstituted benzenoids

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Phenols
Subclass	1-hydroxy-4-unsubstituted benzenoids
Intermediate Tree Nodes	Not available
Direct Parent	1-hydroxy-4-unsubstituted benzenoids
Alternative Parents	1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Pyrazoles Heteroaromatic compounds Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Azole - Pyrazole - Heteroaromatic compound - Ketene acetal or derivatives - Carbonitrile - Nitrile - Organoheterocyclic compound - Azacycle - Oxacycle - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Cyanide - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as 1-hydroxy-4-unsubstituted benzenoids. These are phenols that are unsubstituted at the 4-position.
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

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	504762689
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504762689
IUPAC Name	6-amino-4-(3-hydroxyphenyl)-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
INCHI	InChI=1S/C14H12N4O2/c1-7-11-12(8-3-2-4-9(19)5-8)10(6-15)13(16)20-14(11)18-17-7/h2-5,12,19H,16H2,1H3,(H,17,18)
InChIKey	NEGLIROVJFKWNW-UHFFFAOYSA-N
Smiles	CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=CC=C3)O
Isomeric SMILES	CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=CC=C3)O
PubChem CID	3722212
Molecular Weight	268.276

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

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

Analytical Chart:

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10 results found

Lot Number	Certificate Type	Date	Item
G2319106	Certificate of Analysis	Apr 07, 2023	W416819
G2319098	Certificate of Analysis	Apr 07, 2023	W416819
G2319103	Certificate of Analysis	Apr 07, 2023	W416819
G2319095	Certificate of Analysis	Apr 07, 2023	W416819
G2319093	Certificate of Analysis	Apr 07, 2023	W416819
G2319111	Certificate of Analysis	Apr 07, 2023	W416819
G2319107	Certificate of Analysis	Apr 07, 2023	W416819
G2319110	Certificate of Analysis	Apr 07, 2023	W416819
G2319102	Certificate of Analysis	Apr 07, 2023	W416819
G2319091	Certificate of Analysis	Apr 07, 2023	W416819

Chemical and Physical Properties

Molecular Weight	268.270 g/mol
XLogP3	2.000
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	268.096 Da
Monoisotopic Mass	268.096 Da
Topological Polar Surface Area	108.000 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	469.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
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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