4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL
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4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL
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CAS No:
5373-72-8
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Formula:
C8H7N3S
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Chemical Name:
4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL
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Synonyms:
4-phenyl-2H-1,2,4-triazole-3-thione;4H-1,2,4-triazole-3-thiol,4-phenyl-;4-Phenyl-2H-1,2,4-triazole-3(4H)-thione;4-Phenyl-2,4-dihydro-[1,2,4]triazole-3-thione;4-Phenyl-2,4-dihydro-3H-1,2,4-triazole-3-thione;3H-1,2,4-Triazole-3-thione,2,4-dihydro-4-phenyl-
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CAS No:
Characteristics
65.70000
1.92990
1.33 g/cm3
168-170 °C(Solv: water (7732-18-5))
260.4ºC at 760mmHg
111.3ºC
1.704
Safety Information
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:177.23
XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:177.03606841
Monoisotopic Mass:177.03606841
Topological Polar Surface Area:59.7
Heavy Atom Count:12
Complexity:208
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
4-PHENYL-4H-1,2,4-TRIAZOLE-3-THIOL
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