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3-FLUOROPYRIDINEN-OXIDE

3-FLUOROPYRIDINEN-OXIDE structure

CAS No:
695-37-4
Formula:
C5H4FNO
Chemical Name:
3-FLUOROPYRIDINEN-OXIDE
Synonyms:
3-FLUOROPYRIDINE N-OXIDE;3-fluoro-1-oxidopyridin-1-ium;3-fluoro-1$l^{5}-pyridin-1-one;3-fluoro-1-oxido-pyridin-1-ium;3-fluoro-1-oxidanidyl-pyridin-1-ium
Categories:
Pharmaceutical Intermediates > Heterocyclic Compound

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3-FLUOROPYRIDINEN-OXIDE Basic Attributes

Molecular Weight：

113.09

Exact Mass：

113.027695

EC Number：

1533716-785-6

DSSTox ID：

DTXSID40219730

HScode：

2933399090

Characteristics

PSA：

25.5

XLogP3：

-1.15

Density：

1.2±0.1 g/cm3

Melting Point：

65-68°C

Boiling Point：

275℃

Flash Point：

120℃

Refractive Index：

1.494

Water Solubility：

Slightly soluble in water.

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36

Marks：

Computed Properties

Molecular Weight:113.09
XLogP3:-0.2
Hydrogen Bond Acceptor Count:2
Exact Mass:113.027691913
Monoisotopic Mass:113.027691913
Topological Polar Surface Area:25.5
Heavy Atom Count:8
Complexity:78.8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes