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Home > Encyclopedia > 2,3,6-Trifluorophenylacetic acid

2,3,6-Trifluorophenylacetic acid

2,3,6-Trifluorophenylacetic acid structure

2,3,6-Trifluorophenylacetic acid 

structure
  • CAS No:

    114152-23-7

  • Formula:

    C8H5F3O2

  • Chemical Name:

    2,3,6-Trifluorophenylacetic acid

  • Synonyms:

    Benzeneacetic acid,2,3,6-trifluoro-;2,3,6-Trifluorobenzeneacetic acid;2-(2,3,6-Trifluorophenyl)acetic acid;2,3,6-Trifluorophenylacetic acid

2,3,6-Trifluorophenylacetic acid Basic Attributes

190.12

190.12

DTXSID90380722

Characteristics

1.468±0.06 g/cm3

111-114 °C(lit.)

249.5±35.0 °C(Predicted)

3.53±0.10

Safety Information

IRRITANT

3

36/37/38

26-36

Xi

|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 39 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Computed Properties

Molecular Weight:190.12
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:190.02416388
Monoisotopic Mass:190.02416388
Topological Polar Surface Area:37.3
Heavy Atom Count:13
Complexity:198
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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