Chemical Properties of 5-Phenyl-1,2,3,4-thiatriazole (CAS 34733-85-2)

5-Phenyl-1,2,3,4-thiatriazole

InChI
InChI=1S/C7H5N3S/c1-2-4-6(5-3-1)7-8-9-10-11-7/h1-5H
InChI Key
PXZQTGLTLYTSHC-UHFFFAOYSA-N
Formula
C7H5N3S
SMILES
c1ccc(-c2nnns2)cc1
Molecular Weight1
163.20
CAS
34733-85-2
Other Names
  • Phenyl-1,2,3,4-thiatriazol
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Physical Properties

Property Value Unit Source
ω 0.4113 Relay (1.0) Calculated Property
ΔfG° 434.52 kJ/mol Relay (1.0-beta) Calculated Property
ΔfH°gas 478.08 kJ/mol Relay (1.0) Calculated Property
ΔvapH° 95.31 kJ/mol Relay (1.0) Calculated Property
IE 9.10 eV NIST
log10WS -1.95 Relay (1.0) Calculated Property
logPoct/wat 1.600 Crippen Calculated Property
McVol 112.560 ml/mol McGowan Calculated Property
Pc 5653.16 kPa Relay (1.0-beta) Calculated Property
Tboil 538.05 K Relay (1.0) Calculated Property
Tc 803.95 K Relay (1.0) Calculated Property
Tfus 308.80 K Relay (1.0) Calculated Property
Vc 0.429 m3/kmol Relay (1.0) Calculated Property

Similar Compounds

5,5'-Diphenyl-[2,2'-azo-1,3,4-thiadiazole]. 5-Phenyl-1,2,3-thiadiazole. 1H-Tetrazole, 5-phenyl-. 1-Methyl-5-phenyltetrazole. 1,2,3-Selenadiazole, 4-phenyl-. Isothiazole, 4-phenyl-. 1,2,4,5-Tetrazine, 3,6-diphenyl-. 1H-1,2,3-Triazole, 4-phenyl-. 2,5-Diphenyltetrazole. 1,3,4-Oxadiazole, 2,5-diphenyl-. Benzothiazole, 2-phenyl-. 1H-Pyrazole, 3-methyl-5-phenyl-. 3H-1,2-Dithiole-3-thione, 5-phenyl-. Thiazole, 2-methyl-4-phenyl-. 2-Mercapto-4-phenylthiazole.

Find more compounds similar to 5-Phenyl-1,2,3,4-thiatriazole.

Sources

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