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5-(2,5-Dichlorophenyl)-1H-tetrazole - ≧95%, high purity , CAS No.98555-71-6

COA

Grade & Purity:

≥95%

Cas Number: 98555-71-6
Molecular Weight: 215.04
MDL number: MFCD02093954
PubChem CID: 7010310

In stock

Item Number

B301453

Grouped product items
SKU	Size	Availability	Price	Qty
B301453-250mg	250mg	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$206.90
B301453-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$687.90

Basic Description

Synonyms	5-(2,5-dichlorophenyl)-2H-tetrazole \| 5-(2,5-DICHLOROPHENYL)-1H-TETRAZOLE \| 884504-53-4 \| 5-(2,5-dichlorophenyl)-1H-1,2,3,4-tetrazole \| SCHEMBL5815364 \| SCHEMBL13113385 \| DTXSID60426621 \| KRNRGRZDMYSIHS-UHFFFAOYSA-N \| AC7082 \| MFCD02093954 \| MFCD31654270 \| AKOS022170068 \| AKOS03
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Azoles
    - Subclass Tetrazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Azoles
Subclass	Tetrazoles
Intermediate Tree Nodes	Not available
Direct Parent	Phenyltetrazoles and derivatives
Alternative Parents	Dichlorobenzenes Aryl chlorides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenyltetrazole - 1,4-dichlorobenzene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azacycle - Organochloride - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as phenyltetrazoles and derivatives. These are compounds containing a phenyltetrazole skeleton, which consists of a tetrazole bound to a phenyl group.
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-(2,5-dichlorophenyl)-2H-tetrazole
INCHI	InChI=1S/C7H4Cl2N4/c8-4-1-2-6(9)5(3-4)7-10-12-13-11-7/h1-3H,(H,10,11,12,13)
InChIKey	KRNRGRZDMYSIHS-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1Cl)C2=NNN=N2)Cl
Isomeric SMILES	C1=CC(=C(C=C1Cl)C2=NNN=N2)Cl
PubChem CID	7010310
Molecular Weight	215.04

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

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

Analytical Chart:

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Lot Number	Certificate Type	Date	Item
H2127309	Certificate of Analysis	Jun 09, 2025	B301453

Chemical and Physical Properties

Molecular Weight	215.040 g/mol
XLogP3	2.400
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	213.981 Da
Monoisotopic Mass	213.981 Da
Topological Polar Surface Area	54.500 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	180.000
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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