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4-(1H-Tetrazol-5-yl)phenol - ≥97%, high purity , CAS No.51517-88-5

COA

Grade & Purity:

≥97%

Cas Number: 51517-88-5
Molecular Weight: 162.15
MDL number: MFCD05662709
PubChem CID: 863634
PubChem SID: 504760295

In stock

Item Number

D303853

Grouped product items
SKU	Size	Availability	Price
D303853-250mg	250mg	3	$41.90
D303853-1g	1g	3	$109.90
D303853-5g	5g	3	$380.90

Basic Description

Synonyms	4-(1H-TETRAZOL-5-YL)PHENOL \| 51517-88-5 \| 5-(4-Hydroxyphenyl)tetrazole \| 4-(2h-tetrazol-5-yl)phenol \| MFCD05662709 \| 5-(4-hydroxyphenyl)-1H-tetrazole \| Phenol, 4-(1H-tetrazol-5-yl)- \| NoName_229 \| SCHEMBL595369 \| CHEMBL289030 \| YSCH0310 \| DTXSID50901154 \| DTXSID90419945 \| QOYMNYWF
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 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	1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Heteroaromatic compounds Azacyclic compounds Organooxygen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Phenyltetrazole - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen 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

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	504760295
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504760295
IUPAC Name	4-(2H-tetrazol-5-yl)phenol
INCHI	InChI=1S/C7H6N4O/c12-6-3-1-5(2-4-6)7-8-10-11-9-7/h1-4,12H,(H,8,9,10,11)
InChIKey	QOYMNYWFHZFXHR-UHFFFAOYSA-N
Smiles	C1=CC(=CC=C1C2=NNN=N2)O
Isomeric SMILES	C1=CC(=CC=C1C2=NNN=N2)O
Molecular Weight	162.15
Reaxy-Rn	5332441
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5332441&ln=

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

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Analytical Chart:

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3 results found

Lot Number	Certificate Type	Date	Item
H2206394	Certificate of Analysis	May 07, 2025	D303853
H2206420	Certificate of Analysis	May 07, 2025	D303853
H2206415	Certificate of Analysis	May 07, 2025	D303853

Chemical and Physical Properties

Melt Point(°C)	240°C
Molecular Weight	162.150 g/mol
XLogP3	0.800
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	162.054 Da
Monoisotopic Mass	162.054 Da
Topological Polar Surface Area	74.700 Å²
Heavy Atom Count	12
Formal Charge	0
Complexity	146.000
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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