5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL
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![5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/0e3fdaf453074e12b3dc9432e715632e.png "5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL")
5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL
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CAS No:
261633-26-5
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Formula:
C19H18F3N3S
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Chemical Name:
5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL
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Synonyms:
5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL;5-[4-(TERT-BUTYL)PHENYL]-4-[3-(TRIFLUOROMETHYL)PHENYL]-4H-1,2,4-TRIAZOLE-3-THIOL;5-[4-(tert-Butyl)phenyl]-4-(3-trifluoromethyl)phenyl]-4H-1,2,4-;3H-1,2,4-Triazole-3-thione, 5-[4-(1,1-dimethylethyl)phenyl]-2,4-dihydro-4-[3-(trifluoromethyl)phenyl]-
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CAS No:
5-(4-TERT-BUTYLPHENYL)-4-[3-(TRIFLUOROMETHYL)PHENYL]-1,2,4-TRIAZOLE-3-THIOL Basic Attributes
377.43
377.11735325
DTXSID00372476
2933990090
Characteristics
69.51000
5.53930
1.26±0.1 g/cm3
256 °C
422.5±55.0 °C(Predicted)
209.3ºC
1.584
2.39E-07mmHg at 25°C
5.17±0.20
Computed Properties
Molecular Weight:377.4
XLogP3:5.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:377.11735325
Monoisotopic Mass:377.11735325
Topological Polar Surface Area:59.7
Heavy Atom Count:26
Complexity:559
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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