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3-Amino-5-bromo-1-methyl-1h-indazole - 95%, high purity , CAS No.1000018-06-3

COA

Grade & Purity:

≥95%

Cas Number: 1000018-06-3
Molecular Weight: 226.1
PubChem CID: 26369215

In stock

Item Number

A178636

Grouped product items
SKU	Size	Availability	Price
A178636-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$40.90
A178636-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$111.90
A178636-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$367.90

Basic Description

Synonyms	5-Bromo-1-methyl-1H-indazol-3-amine \| 1000018-06-3 \| 3-Amino-5-bromo-1-methyl-1H-indazole \| 5-bromo-1-methylindazol-3-amine \| 1H-Indazol-3-amine, 5-bromo-1-methyl- \| MFCD09864804 \| SCHEMBL4542207 \| DTXSID50649968 \| BKBSBRJIGMVBFM-UHFFFAOYSA-N \| 3-Amino-5-bromo-1-methylinda
Specifications & Purity	≥95%
Shipped In	Normal

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	Imidolactams Benzenoids Aryl bromides Pyrazoles Heteroaromatic compounds Azacyclic compounds Primary amines Organobromides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzopyrazole - Indazole - Aryl bromide - Aryl halide - Imidolactam - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Azacycle - Organobromide - Organohalogen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Primary amine - Organic nitrogen 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

Names and Identifiers

IUPAC Name	5-bromo-1-methylindazol-3-amine
INCHI	InChI=1S/C8H8BrN3/c1-12-7-3-2-5(9)4-6(7)8(10)11-12/h2-4H,1H3,(H2,10,11)
InChIKey	BKBSBRJIGMVBFM-UHFFFAOYSA-N
Smiles	CN1C2=C(C=C(C=C2)Br)C(=N1)N
Isomeric SMILES	CN1C2=C(C=C(C=C2)Br)C(=N1)N
Molecular Weight	226.1
Reaxy-Rn	24005008
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=24005008&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	226.070 g/mol
XLogP3	1.900
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	224.99 Da
Monoisotopic Mass	224.99 Da
Topological Polar Surface Area	43.800 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	176.000
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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