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4-Chloro-α-formylbenzeneacetonitrile

4-Chloro-α-formylbenzeneacetonitrile structure

CAS No:
62538-21-0
Formula:
C9H6ClNO
Chemical Name:
4-Chloro-α-formylbenzeneacetonitrile
Synonyms:
Benzeneacetonitrile,4-chloro-α-formyl-;Acetaldehyde,(p-chlorophenyl)cyano-;4-Chloro-α-formylbenzeneacetonitrile;2-(4-Chlorophenyl)-2-formylacetonitrile;2-(4-Chlorophenyl)-3-oxopropanenitrile;2-(4-Chloro-phenyl)-3-oxo-propionitrile;2-(4-Chlorophenyl)-2-cyanoacetaldehyde

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4-Chloro-α-formylbenzeneacetonitrile Basic Attributes

Molecular Weight：

179.6

Exact Mass：

179.60

HScode：

2926909090

Characteristics

PSA：

40.9

XLogP3：

2.14608

Density：

1.263 g/cm3

Melting Point：

164-165 °C

Boiling Point：

283.8ºC at 760 mmHg

Flash Point：

125.4ºC

Refractive Index：

1.552

Safety Information

Hazard category：

IRRITANT

Transport codes：

3276

hazard class code：

20/21/22-36/37/38

safety instructions：

26-36/37/39

Marks：

Xi,Xn

Computed Properties

Molecular Weight:179.60
XLogP3:1.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:179.0137915
Monoisotopic Mass:179.0137915
Topological Polar Surface Area:40.9
Heavy Atom Count:12
Complexity:200
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-Chloro-α-formylbenzeneacetonitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

4-Chloro-α-formylbenzeneacetonitrile

SDS

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