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4-bromo-2-methyl-2H-indazole - 97%, high purity , CAS No.590417-93-9

COA

Grade & Purity:

≥97%

Cas Number: 590417-93-9
Molecular Weight: 211.062
PubChem CID: 22559031
PubChem SID: 504769246

In stock

Item Number

B176878

Grouped product items
SKU	Size	Availability	Price
B176878-250mg	250mg	3	$13.90
B176878-1g	1g	3	$39.90
B176878-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$128.90

Basic Description

Synonyms	4-Bromo-2-methyl-2H-indazole \| 590417-93-9 \| 4-Bromo-2-methylindazole \| MFCD09870046 \| CHEMBL2071548 \| 2H-INDAZOLE, 4-BROMO-2-METHYL- \| SCHEMBL544118 \| DTXSID50626451 \| OFOZLGCQBJDWRJ-UHFFFAOYSA-N \| BCP27357 \| BDBM50390024 \| AKOS005258429 \| PB25224 \| PS-5590 \| SY097485 \| 4-Bromo-2-met
Specifications & Purity	≥97%
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 Organoheterocyclic compounds
  - Class Benzopyrazoles
    - Subclass Indazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzopyrazoles
Subclass	Indazoles
Intermediate Tree Nodes	Not available
Direct Parent	Indazoles
Alternative Parents	Benzenoids Aryl bromides Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Indazole - Benzopyrazole - Benzenoid - Aryl halide - Aryl bromide - Heteroaromatic compound - Pyrazole - Azole - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as indazoles. These are compounds containing an indazole, which is structurally characterized by a pyrazole fused to a benzene.
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	504769246
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504769246
IUPAC Name	4-bromo-2-methylindazole
INCHI	InChI=1S/C8H7BrN2/c1-11-5-6-7(9)3-2-4-8(6)10-11/h2-5H,1H3
InChIKey	OFOZLGCQBJDWRJ-UHFFFAOYSA-N
Smiles	CN1C=C2C(=N1)C=CC=C2Br
Isomeric SMILES	CN1C=C2C(=N1)C=CC=C2Br
Molecular Weight	211.062
Reaxy-Rn	14245627
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=14245627&ln=

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

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

Analytical Chart:

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2 results found

Lot Number	Certificate Type	Date	Item
L2021216	Certificate of Analysis	Oct 18, 2022	B176878
L2021215	Certificate of Analysis	Oct 18, 2022	B176878

Chemical and Physical Properties

Molecular Weight	211.060 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	209.979 Da
Monoisotopic Mass	209.979 Da
Topological Polar Surface Area	17.800 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	151.000
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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