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Home > Encyclopedia > 2,3-Difluorobenzeneacetonitrile

2,3-Difluorobenzeneacetonitrile

2,3-Difluorobenzeneacetonitrile structure

2,3-Difluorobenzeneacetonitrile 

structure
  • CAS No:

    145689-34-5

  • Formula:

    C8H5F2N

  • Chemical Name:

    2,3-Difluorobenzeneacetonitrile

  • Synonyms:

    Benzeneacetonitrile,2,3-difluoro-;2,3-Difluorobenzeneacetonitrile;(2,3-Difluorophenyl)acetonitrile;2-(2,3-Difluorophenyl)acetonitrile

  • Categories:

    Organic Chemistry  >  Organic Fluorine Compound

Description

Light brown liquid

2,3-Difluorobenzeneacetonitrile Basic Attributes

153.13

153.13

-0

DTXSID30333858

2926909090

Characteristics

23.8

1.8

colorless transparent liquid

1.234±0.06 g/cm3(Predicted)

24ºC

216.9±25.0 °C(Predicted)

85.0±23.2 °C

1.485

0.136mmHg at 25°C

Safety Information

III

6.1

3276

36/37/38

26-36/37/39

T

Toxic

P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, P501

H301+H311+H331

|Danger|H301+H311+H331 (12.5%): Toxic if swallowed, in contact with skin or if inhaled [Danger Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]|P261, P264, P270, P271, P280, P301+P310, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P311, P312, P321, P322, P330, P332+P313, P337+P313, P361, P362, P363, P403+P233, P405, and P501|Aggregated GHS information provided by 9 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:153.13
XLogP3:1.8
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:172
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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