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3-methylsulfanyl-5-(trifluoromethyl)-1H-1,2,4-triazole

3-methylsulfanyl-5-(trifluoromethyl)-1H-1,2,4-triazole structure

CAS No:
111451-94-6
Formula:
C4H4F3N3S
Chemical Name:
3-methylsulfanyl-5-(trifluoromethyl)-1H-1,2,4-triazole
Synonyms:
111451-94-6;5-(methylthio)-3-(trifluoromethyl)-1H-1,2,4-triazole;5-(methylsulfanyl)-3-(trifluoromethyl)-1H-1,2,4-triazole;NSC366811;SCHEMBL6090705;3-methylsulfanyl-5-(trifluoromethyl)-1H-1,2,4-triazole;SCHEMBL10791094;ZINC6425444;AKOS023791795;GS-1967;MB69309;MCULE-5016137130;NSC-366811;3-(METHYLSULFANYL)-5-(TRIFLUOROMETHYL)-1H-1,2,4-TRIAZOLE

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3-methylsulfanyl-5-(trifluoromethyl)-1H-1,2,4-triazole Basic Attributes

Molecular Weight：

183.16 g/mol

Exact Mass：

183.00780280 g/mol

NSC Number：

366811

Characteristics

PSA：

66.9 Å²

XLogP3：

1.5454

Computed Properties

Molecular Weight:183.16
XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:183.00780280
Monoisotopic Mass:183.00780280
Topological Polar Surface Area:66.9
Heavy Atom Count:11
Complexity:139
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-methylsulfanyl-5-(trifluoromethyl)-1H-1,2,4-triazole

Basic Attributes
Characteristics
Computed Properties

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