52431-78-4

Basic information

• Product Name: 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione
• Synonyms: 4-(5-MERCAPTO-1H-TETRAZOL-1-YL)PHENOL;1-(4-HYDROXYPHENYL)-1H-TETRAZOLE-5-THIO&;1-(4-Hydroxyphenyl)-[1H]-tetrazol-5-thiol;1,2-Dihydro-1-(p-hydroxyphenyl)-5H-tetrazol-5-thion;1-(4-hydroxyphenyl)-2,5-dihydro-1H-1,2,3,4-tetrazole-5-thione;1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol 4-(5-Mercapto-1H-tetrazol-1-yl)phenol;1-(4-Hydroxyphenyl)-5-mercapto-1H-tetrazole;1-(4-Hydroxyphenyl)-1H-tetrazole-5(4H)-thione
• CAS NO: 52431-78-4
• Molecular Formula: C₇H₆N₄OS
• Molecular Weight: 194.21
• EINECS: 257-909-2
• Product Categories: Building Blocks;Heterocyclic Building Blocks;Tetrazoles
• Mol File: 52431-78-4.mol
• Article Data: 3

Chemical Properties

• Melting Point: 170 °C (dec.)(lit.)
• Boiling Point: 332.8 °C at 760 mmHg
• Flash Point: 155.1 °C
• Appearance: /
• Density: 1.63 g/cm³
• Vapor Pressure: 7.35E-05mmHg at 25°C
• Refractive Index: 1.801
• Storage Temp.: Inert atmosphere,Room Temperature
• Solubility: methanol: soluble25mg/mL, clear (colorless to pink to purple)
• PKA: 9.05±0.15(Predicted)
• CAS DataBase Reference: 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione(52431-78-4)
• EPA Substance Registry System: 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione(52431-78-4)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-37/39
• RIDADR: 1325
• WGK Germany: 2
• TSCA: Yes
• HazardClass: 4.1
• PackingGroup: III
• Hazardous Substances Data: 52431-78-4(Hazardous Substances Data)

Usage

Description

1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione is a heterocyclic thionate compound, characterized by its unique chemical structure and properties. It is known for its potential applications in various fields due to its coordination chemistry and reactivity.

Uses

Used in Chemical Synthesis:
1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione is used as a synthetic building block for the creation of organotin(IV) complexes. Its unique structure allows it to act as a ligand in the formation of these complexes, which have potential applications in various industries.
Used in Analytical Chemistry:
In the field of analytical chemistry, 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione is utilized for the iodimetric determination in alkaline medium. This involves volumetric titration with potentiometric end-point detection, which is a valuable technique for the accurate measurement of the compound in various samples.
Used in Coordination Chemistry:
1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione also finds application in coordination chemistry as a ligand with a deprotonated heterocyclic thioamide group. This property enables it to form coordination complexes with various metal ions, which can be studied for their potential applications in different areas, such as catalysis, materials science, and pharmaceuticals.

InChI:InChI=1/C7H6N4OS/c12-6-3-1-5(2-4-6)11-7(13)8-9-10-11/h1-4,12H,(H,8,10,13)

Upstream product

• 23567-67-1 4-[1,2,3,4]thiatriazol-5-ylamino-phenol 
• 145614-31-9 2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>cyclopentanone oxime 
• 145614-35-3 2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>cyclohexanone oxime 
• 145614-61-5 (Z)-2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>-α-tetralone oxime 
• 115786-71-5 1,3-bis<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>propan-2-one oxime 
• 145639-85-6 (Z)-2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>acetaldehyde oxime 
• 145614-20-6 (E)-2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>acetaldehyde oxime 
• 145614-39-7 (E)-2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>indan-1-one oxime 
• 145614-60-4 (Z)-2-<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>indan-1-one oxime 
• 68372-10-1 4-(4-hydroxyphenyl)-3-thiosemicarbazide 
• 123-30-8 4-amino-phenol 
• 30714-45-5 ammonium p-hydroxydithiocarbanilate 

Downstream Products

• 115786-71-5 1,3-bis<1-(4-hydroxyphenyl)-5(1H)-tetrazolylthio>propan-2-one oxime 
• 145614-62-6 [1-(4-Hydroxy-phenyl)-1H-tetrazol-5-ylsulfanyl]-acetaldehyde 
• 165404-63-7 4-{5-[6-(tert-Butyl-dimethyl-silanyloxymethyl)-[1,2]dithiin-3-ylmethylsulfanyl]-tetrazol-1-yl}-phenol 
• 168267-07-0 2-Methoxy-5-(5-methylsulfanyl-tetrazol-1-yl)-benzaldehyde 
• 168267-62-7 5-(5-Methanesulfonyl-tetrazol-1-yl)-2-methoxy-benzaldehyde 
• 168267-54-7 1-(3-[1,3]Dioxolan-2-yl-4-methoxy-phenyl)-5-methylsulfanyl-1H-tetrazole 
• 669055-87-2 4-(5-isopropylsulfanyl-tetrazol-1-yl)-phenol 
• 86878-96-8 1-(4-hydroxy)phenyl-1H-tetrazole-5-thiol, sodium salt 
• 726181-08-4 Me₃Sn(1-(4-hydroxyphenyl)-1H-tetrazole-5-thiol^(1-)) 
• 726181-09-5 (n-Bu)3Sn(1-(4-hydroxyphenyl)-1H-tetrazole-5-thiol^(1-)) 
• 726181-15-3 Ph₂Sn[1-(4-hydroxyphenyl)-1H-tetrazole-5-thiol^(1-)]2 

Relevant articles and documents

1,2-dithiins having antifungal activity

Novel 1,2-dithiin compounds useful as antifungal or anti-infective agents, as well as methods for their use as such, are described. The 1,2-dithiin compounds are particularly effective in treating infections, especially those caused by Candida albicans, Cryptococcus neoformans, Aspergillus fumigatus, Candida krusei, Candida parapsilosis, Candida tropicalis, Trichophyton rubrum, Epidermophyton species, Microsporum species, Sporothrix species, Blastomyces dermatitidis, Coccidiodes immiitis, Histoplasma capsulatum, Herpes virus, Influenza virus, Cytomegalovirus, human immunodeficiency virus, retrovirus, Adenovirus, Papillomavirus, Paravirus, Arenavirus, Bunyavirus, Coronavirus, Paramyxovirus, Picornavirus, Rhabdovirus, Togavirus, Hepadnavirus, Staphylococcus aureus, Streptococcus faecalis, Escherichia coli, Pseudomonas aeruginosa, Enterobacter aerogenes, Klebsiella pneumoniae, Staphylococcus epidermis, Zanthomonus maltrophilia, Acinetobacter, Enterobacter cloacae, Serratia marscens, Listeria, Monocytogenes, Enterococcus faecalis, Streptococcus pyogenes; Streptococcus pneumonia, Viridans streptococci, Haemophilus influenzae, Proteus mirabills, Proteus vulgaris and Bacterioides fragilis.

Preparation of some 1,2,3,4-tetrazoles

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