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264296

Sigma-Aldrich

2,4-Difluorobenzoic acid

98%

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About This Item

Linear Formula:
F2C6H3CO2H
CAS Number:
Molecular Weight:
158.10
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

98%

mp

188-190 °C (lit.)

SMILES string

OC(=O)c1ccc(F)cc1F

InChI

1S/C7H4F2O2/c8-4-1-2-5(7(10)11)6(9)3-4/h1-3H,(H,10,11)

InChI key

NJYBIFYEWYWYAN-UHFFFAOYSA-N

General description

Molecular conformation, vibrational and electronic transition analysis of 2,4-difluorobenzoic acid has been investigated by experimental techniques (FT-IR, FT-Raman and UV) and quantum chemical calculations.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Jiaqing Guo et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 240, 118592-118592 (2020-07-03)
Low-toxic and environmentally friendly carbon dots (CDs) have been extensively applied in various fields. CDs usually demonstrate excellent selectivity and high sensitivity, especially in ion detection. However, the most commonly used CDs are excited by ultraviolet (UV) light and emit
Mehmet Karabacak et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 79(5), 1511-1519 (2011-06-08)
In this study, the molecular conformation, vibrational and electronic transition analysis of 2,3-difluorobenzoic acid and 2,4-difluorobenzoic acid (C7H4F2O2) were presented using experimental techniques (FT-IR, FT-Raman and UV) and quantum chemical calculations. FT-IR and FT-Raman spectra in solid state were recorded

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