5-[(4-Methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione
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![5-[(4-Methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/b5f95c12281e46aabecec22f0a38d7f5.png "5-[(4-Methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione")
5-[(4-Methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione
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CAS No:
14731-25-0
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Formula:
C9H9N3S2
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Chemical Name:
5-[(4-Methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione
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Synonyms:
1,3,4-Thiadiazole-2(3H)-thione,5-[(4-methylphenyl)amino]-;1,3,4-Thiadiazole-2-thiol,5-p-toluidino-;5-[(4-Methylphenyl)amino]-1,3,4-thiadiazole-2(3H)-thione;1,3,4-Thiadiazolidine-2-thione,5-(p-tolylimino)-;2-(p-Tolylamino)-5-mercapto-1,3,4-thiadiazole;5-p-Toluidino-1,3,4-thiadiazole-2-thiol;5-(p-Toluidino)-1,3,4-thiadiazole-2(3H)-thione;5-(4-Methylanilino)-1,3,4-thiadiazol-2-ylthiol;NSC 135812;27385-91-7;42238-58-4
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CAS No:
Characteristics
101.04000
3.32570
1.42g/cm3
217-218 °C
332.7ºC at 760mmHg
155ºC
1.736
0.000144mmHg at 25°C
Safety Information
|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:223.3
XLogP3:2.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:223.02378965
Monoisotopic Mass:223.02378965
Topological Polar Surface Area:93.8
Heavy Atom Count:14
Complexity:257
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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