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7-iodo-1H-indazole - 97%, high purity , CAS No.945761-94-4

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7-iodo-1H-indazole - 97%, high purity , CAS No.945761-94-4

COA

Grade & Purity:

≥97%

Cas Number: 945761-94-4
Molecular Weight: 244.03
PubChem CID: 16726525
PubChem SID: 488199415

In stock

Item Number

I178431

Grouped product items
SKU	Size	Availability	Price
I178431-100mg	100mg	3	$18.90
I178431-250mg	250mg	7	$39.90
I178431-1g	1g	4	$131.90
I178431-5g	5g	2	$590.90

Basic Description

Synonyms	7-Iodo-1H-indazole \| 945761-94-4 \| 7-Iodo (1H)indazole \| 1h-indazole,7-iodo- \| CHEMBL510569 \| MFCD09263215 \| 7-Iodoindazole \| 2-methoxycinnamaldehyd \| SCHEMBL12930782 \| DTXSID40587385 \| AMY21650 \| BCP26685 \| VMB76194 \| BDBM50271276 \| AKOS015853743 \| PB12605 \| AS-40784 \| SY098815 \| CS-005001
Specifications & Purity	≥97%
Storage Temp	Store at 2-8°C,Protected from light
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 iodides Pyrazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organoiodides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzopyrazole - Indazole - Aryl halide - Aryl iodide - Benzenoid - Azole - Heteroaromatic compound - Pyrazole - Azacycle - Organoiodide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organopnictogen 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

Associated Targets(Human)

NOS1 Tchem Nitric-oxide synthase, brain (1786 Activities)

Discover Target: NOS1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Nos2 Nitric oxide synthase, inducible (3573 Activities)

Discover Target: Nos2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

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	488199415
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488199415
IUPAC Name	7-iodo-1H-indazole
INCHI	InChI=1S/C7H5IN2/c8-6-3-1-2-5-4-9-10-7(5)6/h1-4H,(H,9,10)
InChIKey	JBCFWHAFVDMAEU-UHFFFAOYSA-N
Smiles	C1=CC2=C(C(=C1)I)NN=C2
Isomeric SMILES	C1=CC2=C(C(=C1)I)NN=C2
Molecular Weight	244.03
Reaxy-Rn	10787017
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10787017&ln=

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

8 results found

Lot Number	Certificate Type	Date	Item
G2315148	Certificate of Analysis	Jun 21, 2023	I178431
G2315178	Certificate of Analysis	Jun 21, 2023	I178431
G2315353	Certificate of Analysis	Jun 21, 2023	I178431
G2315152	Certificate of Analysis	Jun 21, 2023	I178431
G2315169	Certificate of Analysis	Jun 21, 2023	I178431
G2315179	Certificate of Analysis	Jun 21, 2023	I178431
G2315155	Certificate of Analysis	Jun 21, 2023	I178431
G2315181	Certificate of Analysis	Jun 21, 2023	I178431

Chemical and Physical Properties

Sensitivity	Light sensitive
Molecular Weight	244.030 g/mol
XLogP3	2.200
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	243.95 Da
Monoisotopic Mass	243.95 Da
Topological Polar Surface Area	28.700 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	129.000
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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