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Home > Encyclopedia > 2,3,4-Trifluorobenzoic acid

2,3,4-Trifluorobenzoic acid

2,3,4-Trifluorobenzoic acid structure

2,3,4-Trifluorobenzoic acid 

structure
  • CAS No:

    61079-72-9

  • Formula:

    C7H3F3O2

  • Chemical Name:

    2,3,4-Trifluorobenzoic acid

  • Synonyms:

    Benzoic acid,2,3,4-trifluoro-;2,3,4-Trifluorobenzoic acid;NSC 190684

  • Categories:

    Organic Chemistry  >  Organic Fluorine Compound

Description

white to light yellow crystal powder

2,3,4-Trifluorobenzoic acid Basic Attributes

176.09

176.09

7476020

612-077-3

190684

DTXSID70307311

2916399090

Characteristics

37.3

1.7

white to light yellow crystal powder

1.5±0.1 g/cm3

141 °C

245.3°C at 760 mmHg

102.1±25.9 °C

1.491

Safety Information

IRRITANT

NONH for all modes of transport

3

36/37/38

26-37/39-36

Xi

Irritant

P261-P305 + P351 + P338

H315-H319-H335

|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 49 companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

2,3,4-tri-fluoro-benzoic acid

2,3,4-Trifluorobenzoic acid Use and Manufacturing

Uses

2,3,4-Trifluorobenzoic Acid is used in the preparation of benzamide derivatives with potential anti-cancer properties. It is also used in the preparation of polyfluoroaryl oxazoline compounds.

Benzoic acid, 2,3,4-trifluoro-: ACTIVE|PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.

Computed Properties

Molecular Weight:176.09
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:176.00851382
Monoisotopic Mass:176.00851382
Topological Polar Surface Area:37.3
Heavy Atom Count:12
Complexity:186
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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