5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
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![5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/da4d502cc17648e6824067854924f0cc.png "5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid")
5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
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CAS No:
499771-21-0
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Formula:
C11H8F3N3O2
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Chemical Name:
5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
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Synonyms:
1H-1,2,3-Triazole-4-carboxylic acid,5-methyl-1-[3-(trifluoromethyl)phenyl]-;5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid
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CAS No:
5-Methyl-1-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxylic acid Basic Attributes
271.19500
271.20
DTXSID40384417
2933990090
Safety Information
R36/37/38
S26-S37/39
Xi
|Warning|H303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, 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:271.19
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:2
Exact Mass:271.05686099
Monoisotopic Mass:271.05686099
Topological Polar Surface Area:68
Heavy Atom Count:19
Complexity:351
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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