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5-Fluoro-2-methyl-β-oxobenzenepropanenitrile

5-Fluoro-2-methyl-β-oxobenzenepropanenitrile structure

CAS No:
884504-23-8
Formula:
C10H8FNO
Chemical Name:
5-Fluoro-2-methyl-β-oxobenzenepropanenitrile
Synonyms:
Benzenepropanenitrile,5-fluoro-2-methyl-β-oxo-;5-Fluoro-2-methyl-β-oxobenzenepropanenitrile

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5-Fluoro-2-methyl-β-oxobenzenepropanenitrile Basic Attributes

Molecular Weight：

177.17500

Exact Mass：

177.18

DSSTox ID：

DTXSID10645209

Characteristics

PSA：

40.86000

XLogP3：

2.23048

Density：

1.17g/cm3

Boiling Point：

317.7ºC at 760 mmHg

Flash Point：

145.9ºC

Refractive Index：

1.515

Computed Properties

Molecular Weight:177.17
XLogP3:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:177.058992041
Monoisotopic Mass:177.058992041
Topological Polar Surface Area:40.9
Heavy Atom Count:13
Complexity:243
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 5-Fluoro-2-methyl-β-oxobenzenepropanenitrile

Basic Attributes
Characteristics
Computed Properties

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