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2,4-Dichloro-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile

2,4-Dichloro-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile structure

CAS No:
138716-56-0
Formula:
C12H10Cl2N2O
Chemical Name:
2,4-Dichloro-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile
Synonyms:
Benzenepropanenitrile,2,4-dichloro-α-[(dimethylamino)methylene]-β-oxo-;2,4-Dichloro-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile;2-(2,4-Dichlorobenzoyl)-3-(dimethylamino)acrylonitrile;2-[(Dimethylamino)methylene]-3-oxo-3-(2,4-dichlorophenyl)propanenitrile

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2,4-Dichloro-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile Basic Attributes

Molecular Weight：

269.12700

Exact Mass：

269.13

DSSTox ID：

DTXSID90694134

Characteristics

PSA：

44.10000

XLogP3：

3.14518

Density：

1.223g/cm3

Boiling Point：

331.5ºC at 760mmHg

Flash Point：

154.3ºC

Refractive Index：

1.579

Vapor Pressure：

3.76E-09mmHg at 25°C

Safety Information

Marks：

Computed Properties

Molecular Weight:269.12
XLogP3:3.2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:268.0170183
Monoisotopic Mass:268.0170183
Topological Polar Surface Area:44.1
Heavy Atom Count:17
Complexity:370
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,4-Dichloro-α-[(dimethylamino)methylene]-β-oxobenzenepropanenitrile

Basic Attributes
Characteristics
Safety Information
Computed Properties

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