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52431-78-4

52431-78-4 Structure

52431-78-4 Structure
IdentificationMore
[Name]

1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione
[CAS]

52431-78-4
[Synonyms]

1,2-Dihydro-1-(p-hydroxyphenyl)-5H-tetrazole-5-thione
1-(4-HYDROXYPHENYL)-1H-TETRAZOLE-5-THIOL
1-(4-hydroxyphenyl)-2h-tetrazole-5-thione
1-(4-HYDROXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
1-(4-HYDROXYPHENYL)-5-MERCAPTOTETRAZOLE
1-(4-HYDROXYPHENYL)TETRAZOLE-5-THIOL
1-(P-HYDROXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
4-(5-MERCAPTO-1H-1,2,3,4-TETRAAZOL-1-YL)PHENOL
4-(5-MERCAPTO-1H-TETRAZOL-1-YL)PHENOL
1,2-dihydro-1-(4-hydroxyphenyl)-5h-tetrazole-5-thion
1-(4-HYDROXYPHENYL)-1H-TETRAZOLE-5-THIO&
1-(4-Hydroxyphenyl)-[1H]-tetrazol-5-thiol
1,2-Dihydro-1-(p-hydroxyphenyl)-5H-tetrazol-5-thion
[EINECS(EC#)]

257-909-2
[Molecular Formula]

C7H6N4OS
[MDL Number]

MFCD00132898
[Molecular Weight]

194.21
[MOL File]

52431-78-4.mol
Chemical PropertiesBack Directory
[Melting point ]

170 °C (dec.)(lit.)
[Boiling point ]

332.8±44.0 °C(Predicted)
[density ]

1.63±0.1 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

methanol: soluble25mg/mL, clear (colorless to pink to purple)
[form ]

powder to crystal
[pka]

9.05±0.15(Predicted)
[color ]

White to Almost white
[InChI]

1S/C7H6N4OS/c12-6-3-1-5(2-4-6)11-7(13)8-9-10-11/h1-4,12H,(H,8,10,13)
[InChIKey]

MOXZSKYLLSPATM-UHFFFAOYSA-N
[SMILES]

Oc1ccc(cc1)-n2nnnc2S
[CAS DataBase Reference]

52431-78-4(CAS DataBase Reference)
[EPA Substance Registry System]

52431-78-4(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

1325
[WGK Germany ]

2
[TSCA ]

Yes
[HazardClass ]

4.1
[PackingGroup ]

III
[HS Code ]

2933998090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol may be used in the synthesis of organotin(IV) complexes.
[General Description]

1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol is a heterocyclic thionate. Iodimetric determination of 1-(4-hydroxyphenyl)-1H-tetrazole-5-thiol in alkaline medium, via volumetric titration with potentiometric end-point detection is reported. Coordination chemistry of 1-(4-hydroxyphenyl)-1H-tetrazole-5-thiol as ligand, having deprotonated heterocyclic thioamide group, has been reported.
Spectrum DetailBack Directory
[Spectrum Detail]

1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione(52431-78-4)1HNMR
1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione(52431-78-4)IR
1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione(52431-78-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

1-(4-Hydroxyphenyl)-5-mercaptotetrazole, 96%(52431-78-4)
[Sigma Aldrich]

52431-78-4(sigmaaldrich)
[TCI AMERICA]

1-(4-Hydroxyphenyl)-5-mercapto-1H-tetrazole,>90.0%(T)(52431-78-4)
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