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5-bromo-1-but-2-ynyl-3-nitro-1,2,4-triazole

5-bromo-1-but-2-ynyl-3-nitro-1,2,4-triazole structure

CAS No:
667901-22-6
Formula:
C6H5BrN4O2
Chemical Name:
5-bromo-1-but-2-ynyl-3-nitro-1,2,4-triazole
Synonyms:
5-bromo-1-but-2-ynyl-3-nitro-1H-1,2,4-triazole;ZINC2196501;STK547699;AKOS005475612;MCULE-4072453429;667901-22-6;AP-853/41543832;5-bromo-1-(but-2-yn-1-yl)-3-nitro-1H-1,2,4-triazole

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5-bromo-1-but-2-ynyl-3-nitro-1,2,4-triazole Basic Attributes

Molecular Weight：

245.03 g/mol

Exact Mass：

243.95959 g/mol

Characteristics

PSA：

76.5 Å²

Computed Properties

Molecular Weight:245.03
XLogP3:1.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:243.95959
Monoisotopic Mass:243.95959
Topological Polar Surface Area:76.5
Heavy Atom Count:13
Complexity:265
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-bromo-1-but-2-ynyl-3-nitro-1,2,4-triazole

Basic Attributes
Characteristics
Computed Properties

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