1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol supplier

Name
1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione
EINECS 257-909-2
CAS No. 52431-78-4
Article Data4
CAS DataBase
Density 1.63 g/cm³
Solubility 1.63 g/cm³
Melting Point 170 °C (dec.)(lit.)
Formula C₇H₆N₄OS
Boiling Point 332.8 °C at 760 mmHg
Molecular Weight 194.217
Flash Point 155.1 °C
Transport Information
Appearance
Safety 155.1 °C
Risk Codes 332.8 °C at 760 mmHg
Molecular Structure
Hazard Symbols Xi
Synonyms 1,2-dihydro-1-(4-hydroxyphenyl)-5h-tetrazole-5-thion;1-(4-HYDROXYPHENYL)-1H-TETRAZOLE-5-THIOL;1-(4-hydroxyphenyl)-2h-tetrazole-5-thione;1-(4-HYDROXYPHENYL)TETRAZOLE-5-THIOL;1-(4-HYDROXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE;1-(4-HYDROXYPHENYL)-5-MERCAPTOTETRAZOLE;1,2-Dihydro-1-(p-hydroxyphenyl)-5H-tetrazole-5-thione;1-(P-HYDROXYPHENYL)-5-MERCAPTO-1H-TETRAZOLE
PSA 102.63000
LogP 0.65660

1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol Chemical Properties

IUPAC Name: 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione
Synonyms of 1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol (CAS NO.52431-78-4): 1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione ; 1-(4-Hydroxyphenyl)-5-mercaptotetrazole ; 1,2-Dihydro-1-(p-hydroxyphenyl)-5H-tetrazole-5-thione
CAS NO: 52431-78-4
Molecular Formula: C₇H₆N₄OS
Molecular Weight: 194.21
Molecular Structure:
EINECS: 257-909-2
H bond acceptors: 5
H bond donors: 2
Freely Rotating Bonds: 2
Polar Surface Area: 72.52 Å²
Index of Refraction: 1.801
Molar Refractivity: 51 cm³
Molar Volume: 119.1 cm³
Surface Tension: 68.6 dyne/cm
Density: 1.63 g/cm³
Flash Point: 155.1 °C
Enthalpy of Vaporization: 59.85 kJ/mol
Boiling Point: 332.8 °C at 760 mmHg
Vapour Pressure: 7.35E-05 mmHg at 25°C
Melting Point: 170 °C (dec.)(lit.)
SMILES: S=C2/N=N\NN2c1ccc(O)cc1
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)
InChIKey: MOXZSKYLLSPATM-UHFFFAOYAH
Std. InChI: 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)
Std. InChIKey: MOXZSKYLLSPATM-UHFFFAOYSA-N
Product Categories of 1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol (CAS NO.52431-78-4): Building Blocks;Heterocyclic Building Blocks;Tetrazoles

1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol Safety Profile

Hazard Codes: Irritant Xi
Risk Statements: 36/37/38
R36/37/38: Irritating to eyes, respiratory system and skin.
Safety Statements: 26-37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S37/39: When1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol (CAS NO.52431-78-4) is used, please wear suitable gloves and eye/face protection.
WGK Germany: 2

Product Name

1-(4-Hydroxyphenyl)-2H-tetrazole-5-thione

1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol Chemical Properties

1-(4-Hydroxyphenyl)-1H-tetrazole-5-thiol Safety Profile

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