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3-naphthalen-1-yl-3-oxopropanenitrile

3-naphthalen-1-yl-3-oxopropanenitrile structure

CAS No:
39528-57-9
Formula:
C13H9NO
Chemical Name:
3-naphthalen-1-yl-3-oxopropanenitrile
Synonyms:
3-Oxo-3-(naphthyl-(1))-propionsaeure-nitril; 1-Naphthoylacetonitrile; 1-Naphthalenepropanenitrile,b-oxo; 2-(naphthalen-1-carbonyl)acetonitrile; 3-[1]naphthyl-3-oxo-propionitrile; 3-[1]Naphthyl-3-oxo-propionitril; 2-(naphthalene-1-carbonyl)acetonitrile; 3-Naphthalen-1-yl-3-oxo-propionitrile; 3-(1-Naphthyl)-3-oxopropanenitrile;Expand

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3-naphthalen-1-yl-3-oxopropanenitrile Basic Attributes

Molecular Weight：

195.21700

Exact Mass：

195.068413911

DSSTox ID：

DTXSID40620529

Characteristics

PSA：

40.86000

XLogP3：

2.93618

Density：

1.183g/cm3

Boiling Point：

405.014ºC

Flash Point：

198.746ºC

Refractive Index：

1.63

Computed Properties

Molecular Weight:195.22
XLogP3:2.7
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:195.068413911
Monoisotopic Mass:195.068413911
Topological Polar Surface Area:40.9
Heavy Atom Count:15
Complexity:288
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-naphthalen-1-yl-3-oxopropanenitrile

Basic Attributes
Characteristics
Computed Properties

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