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Home > Encyclopedia > 3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride

3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride

3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride structure

3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride 

structure
  • CAS No:

    55805-13-5

  • Formula:

    C8H5F2N

  • Chemical Name:

    3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride

  • Synonyms:

    3-(Difluoromethyl)benzonitrile;3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride;alpha,alpha-Difluoro-m-tolunitrile, 3-Cyanobenzal fluoride;1-Cyano-3-(difluoromethyl)benzene

3-Cyano-alpha,alpha-difluorotoluene, 3-Cyanobenzal fluoride Basic Attributes

153.1288064

153.03900

DTXSID70624095

2926909090

Characteristics

23.8

2.49588

1.228 g/mL at 25 °C

>110℃

2-8°C

Safety Information

UN 3265 8 / PGII

3

34-36

26-36/37/39-45

C

P273-P280-P305 + P351 + P338-P310

H314-H412

Computed Properties

Molecular Weight:153.13
XLogP3:2.3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:153.03900549
Monoisotopic Mass:153.03900549
Topological Polar Surface Area:23.8
Heavy Atom Count:11
Complexity:170
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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