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3-[6-chloro-2-(trifluoromethyl)benzimidazol-1-yl]propanenitrile

3-[6-chloro-2-(trifluoromethyl)benzimidazol-1-yl]propanenitrile structure

CAS No:
100447-42-5
Formula:
C11H7ClF3N3
Chemical Name:
3-[6-chloro-2-(trifluoromethyl)benzimidazol-1-yl]propanenitrile
Synonyms:
6-Chloro-1-(2-cyanoethyl)-2-trifluoromethylbenzimidazole; 6-Chloro-2-trifluoromethyl-1-benzimidazolepropionitrile; 1-Benzimidazolepropionitrile,6-chloro-2-(trifluoromethyl); 3-[6-chloro-2-(trifluoromethyl)-1h-benzimidazol-1-yl]propanenitrile; 1H-Benzimidazole-1-propanenitrile,6-chloro-2-(trifluoromethyl);

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3-[6-chloro-2-(trifluoromethyl)benzimidazol-1-yl]propanenitrile Basic Attributes

Molecular Weight：

273.64200

Exact Mass：

273.0280594 g/mol

NSC Number：

135987

DSSTox ID：

DTXSID00143284

Characteristics

PSA：

41.61000

XLogP3：

3.62218

Density：

1.45g/cm3

Boiling Point：

385ºC

Flash Point：

183.9ºC

Refractive Index：

1.57

Vapor Pressure：

5.42E-06mmHg at 25°C

Computed Properties

Molecular Weight:273.64
XLogP3:2.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:273.0280594
Monoisotopic Mass:273.0280594
Topological Polar Surface Area:41.6
Heavy Atom Count:18
Complexity:351
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[6-chloro-2-(trifluoromethyl)benzimidazol-1-yl]propanenitrile

Basic Attributes
Characteristics
Computed Properties

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