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5-Chloro-2H-benzo[d][1,2,3]triazole - 98%, high purity , CAS No.1185742-20-4

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5-Chloro-2H-benzo[d][1,2,3]triazole - 98%, high purity , CAS No.1185742-20-4

COA

Grade & Purity:

≥98%

Cas Number: 1185742-20-4
Molecular Weight: 153.57
EC Number: ‘202-378-4
PubChem CID: 66760

In stock

Item Number

C586524

Grouped product items
SKU	Size	Availability	Price	Qty
C586524-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$10.90
C586524-25g	25g	2	$18.90

Basic Description

Synonyms	NSC16507 \| NSC-16507 \| 1H-Benzotriazole, 5-chloro- \| 6-chloro-1-h-benzotriazole \| 6-Chloro-1H-benzotriazole \| CAS-94-97-3 \| NSC58361 \| NSC-58361 \| 6-chloro-benzotriazole \| 8C7O46G78K \| AKOS005061649 \| InChI=1/C6H4ClN3/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,8,
Specifications & Purity	≥98%
Storage Temp	Store at 2-8°C,Protected from light,Desiccated
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 Benzotriazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzotriazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzotriazoles
Alternative Parents	Benzenoids Aryl chlorides Triazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzotriazole - Aryl chloride - Aryl halide - Benzenoid - Azole - Triazole - 1,2,3-triazole - Heteroaromatic compound - Azacycle - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzotriazoles. These are organic compounds containing a benzene fused to a triazole ring (a five-membered ring with two carbon atoms and three nitrogen atoms).
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)

DYRK1A Tchem Dual-specificity tyrosine-phosphorylation regulated kinase 1A (6484 Activities)

Discover Target: DYRK1A

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

IUPAC Name	5-chloro-2H-benzotriazole
INCHI	InChI=1S/C6H4ClN3/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H,(H,8,9,10)
InChIKey	PZBQVZFITSVHAW-UHFFFAOYSA-N
Smiles	C1=CC2=NNN=C2C=C1Cl
Isomeric SMILES	C1=CC2=NNN=C2C=C1Cl
NSC Number	NSC Number': ['16507; 58361
Molecular Weight	153.57
Reaxy-Rn	509776
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=509776&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.

2 results found

Lot Number	Certificate Type	Date	Item
H2308655	Certificate of Analysis	Jul 22, 2023	C586524
H2308645	Certificate of Analysis	Jul 22, 2023	C586524

Chemical and Physical Properties

Molecular Weight	153.570 g/mol
XLogP3	1.700
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	153.009 Da
Monoisotopic Mass	153.009 Da
Topological Polar Surface Area	41.600 Å²
Heavy Atom Count	10
Formal Charge	0
Complexity	130.000
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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