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3-(3-Methoxyphenyl)-3-oxopropanenitrile

3-(3-Methoxyphenyl)-3-oxopropanenitrile structure

CAS No:
21667-60-7
Formula:
C10H9NO2
Chemical Name:
3-(3-Methoxyphenyl)-3-oxopropanenitrile
Synonyms:
3-(3-methoxyphenyl)-3-oxopropanenitrile;

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3-(3-Methoxyphenyl)-3-oxopropanenitrile Basic Attributes

Molecular Weight：

175.18400

Exact Mass：

175.063328530 g/mol

DSSTox ID：

DTXSID60342817

HScode：

2926909090

Characteristics

PSA：

50.09000

XLogP3：

1.79158

Density：

1.131g/cm3

Melting Point：

89-91ºC

Boiling Point：

331.8ºC

Flash Point：

144.6ºC

Refractive Index：

1.525

Vapor Pressure：

0.000152mmHg at 25°C

Safety Information

Marks：

Computed Properties

Molecular Weight:175.18
XLogP3:1.7
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:175.063328530
Monoisotopic Mass:175.063328530
Topological Polar Surface Area:50.1
Heavy Atom Count:13
Complexity:228
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-(3-Methoxyphenyl)-3-oxopropanenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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