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1-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetone

1-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetone structure

CAS No:
53866-15-2
Formula:
C5H5BrN4O3
Chemical Name:
1-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetone
Synonyms:
1-(5-bromo-3-nitro-1H-1,2,4-triazol-1-yl)propan-2-one;CTK1E3539;DTXSID20361120;ZINC997208;BBL004049;STK099417;AKOS003366073;MCULE-7340600198;T8910;AG-670/33303004

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1-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetone Basic Attributes

Molecular Weight：

249.0222

Exact Mass：

247.955

DSSTox ID：

DTXSID20361120

Characteristics

PSA：

93.6

XLogP3：

Computed Properties

Molecular Weight:249.02
XLogP3:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:247.95450
Monoisotopic Mass:247.95450
Topological Polar Surface Area:93.6
Heavy Atom Count:13
Complexity:230
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetone

Basic Attributes
Characteristics
Computed Properties

1-{5-bromo-3-nitro-1H-1,2,4-triazol-1-yl}acetone

SDS

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