Hazard Codes | Xn,Xi |
Risk Statements | 20/22 |
Safety Statements | 22-26-36 |
WGK Germany | 3 |
Molecular Structure of 2-Amino-5-tert-butyl-1,3,4-thiadiazole (CAS No.39222-73-6):
Molecular Formula: C6H11N3S
Molecular Weight: 157.2366
IUPAC Name: 5-Tert-butyl-1,3,4-thiadiazol-2-amine
CAS No: 39222-73-6
H bond acceptors: 3
H bond donors: 2
Freely Rotating Bonds: 1
Polar Surface Area: 57.26 Å2
Index of Refraction: 1.56
Molar Refractivity: 43.44 cm3
Molar Volume: 134.3 cm3
Polarizability: 17.22 10-24cm3
Surface Tension: 47.4 dyne/cm
Density: 1.17 g/cm3
Flash Point: 118.5 °C
Melting point: 183-187 ºC
Enthalpy of Vaporization: 51.06 kJ/mol
Boiling Point: 272.3 °C at 760 mmHg
Vapour Pressure: 0.00612 mmHg at 25°C
InChI: InChI=1/C6H11N3S /c1-6(2,3)4-8-9-5(7)10-4/h1-3H3,(H2,7,9)
InChIKey: ICXDPEFCLDSXLI-UHFFFAOYAH
Std. InChI: InChI=1S/C6H11N3S /c1-6(2,3)4-8-9-5(7)10-4/h1-3H3,(H2,7,9)
Std. InChIKey: ICXDPEFCLDSXLI-UHFFFAOYSA-N
Synonyms of 2-Amino-5-tert-butyl-1,3,4-thiadiazole (CAS No.39222-73-6): 1,3,4-thiadiazol-2-amine, 5-(1,1-dimethylethyl)- ;5-tert-Butyl-1,3,4-thiadiazol-2-amine
Product Categories: API intermediates;Heterocyclic Compounds;Heterocycles;Building Blocks;Heterocyclic Building Blocks;Thiadiazoles
Hazard Codes:Xn,Xi
Risk Statements:20/22
R20/22:Harmful by inhalation and if swallowed.
Safety Statements:22-26-36
S22:Do not breathe dust.
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36:Wear suitable protective clothing.
WGK Germany:3
HazardClass:IRRITANT
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