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2-(4-fluoro-3-nitrophenyl)acetonitrile

2-(4-fluoro-3-nitrophenyl)acetonitrile structure

CAS No:
157662-77-6
Formula:
C8H5FN2O2
Chemical Name:
2-(4-fluoro-3-nitrophenyl)acetonitrile
Synonyms:
3-nitro-4-fluorobenzylnitrile; 4-Fluoro-3-nitrobenzylnitrile;

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2-(4-fluoro-3-nitrophenyl)acetonitrile Basic Attributes

Molecular Weight：

180.13600

Exact Mass：

180.03350557

DSSTox ID：

DTXSID00466465

Characteristics

PSA：

69.61000

XLogP3：

2.32318

Density：

1.368g/cm3

Boiling Point：

349.982ºC

Flash Point：

165.464ºC

Refractive Index：

1.555

Vapor Pressure：

0mmHg at 25°C

Computed Properties

Molecular Weight:180.14
XLogP3:1.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:180.03350557
Monoisotopic Mass:180.03350557
Topological Polar Surface Area:69.6
Heavy Atom Count:13
Complexity:242
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-(4-fluoro-3-nitrophenyl)acetonitrile

Basic Attributes
Characteristics
Computed Properties

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