5-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine
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![5-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/b0e3bab81be843548dc61ca732900b3d.png "5-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine")
5-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine
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CAS No:
502686-01-3
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Formula:
C9H7F3N4
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Chemical Name:
5-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine
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Synonyms:
5-(3-(trifluoromethyl)phenyl)-4H-1,2,4-triazol-3-amine; 3-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-5-amine;
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CAS No:
5-[3-(Trifluoromethyl)phenyl]-1H-1,2,4-triazol-3-amine Basic Attributes
228.17400
228.06228073
DTXSID90391292
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Computed Properties
Molecular Weight:228.17
XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:228.06228073
Monoisotopic Mass:228.06228073
Topological Polar Surface Area:67.6
Heavy Atom Count:16
Complexity:245
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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