4-Fluoro-3-nitrobenzoic acid

Basic Information

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CAS Number

453-71-4

Molecular Formula

C7H4FNO4

Molecular Weight

185.11 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

120.0 to 124.0 deg-C

Boiling Point

356.9°C at 760 mmHg

Flash Point

92℃/15mm

Solubility

95% ethanol: soluble50mg/mL, clear, light yellow

Vapor Pressure

0.0±0.8 mmHg at 25°C

SMILES

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C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])F

InChI

InChI=1S/C7H4FNO4/c8-5-2-1-4(7(10)11)3-6(5)9(12)13/h1-3H,(H,10,11)

InChIKey

BOJWTAQWPVBIPG-UHFFFAOYSA-N

LogP

1.95530

Complexity

227

Safety Information

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GHS Hazard Pictograms

H302

H315

H319

H335

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

NSC 10311
4XU69FAU2V
453-71-4
Z89284934
AS-10821
NS00043544
EN300-18726
4-fluoro-5-nitrobenzoic acid
AKOS000283434
SCHEMBL24994
4-Fluoro-3-nitrobenzoic acid, ~99%
(R)-alpha-Ethyl-2-oxo-1-pyrrolidineacetic acid (Levetiracetam acid)
A7154
F0399
p-Fluoro-3-nitrobenzoic acid
SY004060
CS-W008650
FT-0618488
DTXSID30196465
UNII-4XU69FAU2V
AB00828
4-Fluoro-3-nitro-benzoic acid
MFCD00007058
AC-3149
3-nitro-4-fluoro benzoic acid
3-nitro-4-flurobenzoic acid
4-Fluoro-3-nitrobenzoic acid, 98%
4-fluoro-3-nitro benzoic acid
EINECS 207-221-3
3-Nitro-4-fluorobenzoic acid
NSC10311

MDL Number

MFCD00007058

Customs Code

2916399090

FAQ

What is 4-Fluoro-3-nitrobenzoic acid (CAS: 453-71-4)?

4-Fluoro-3-nitrobenzoic acid (CAS 453-71-4) is an organic compound with the molecular formula C7H4FN2O4. It is a white crystalline solid with a pungent odor and is used in various applications including pharmaceuticals and research. It is soluble in water and less soluble in organic solvents.

What are the main uses of 4-Fluoro-3-nitrobenzoic acid (CAS: 453-71-4)?

4-Fluoro-3-nitrobenzoic acid is primarily used in the synthesis of pharmaceuticals and as an intermediate in the production of other organic compounds. It also finds applications in chemical research and development, where its unique properties make it useful for specific reactions and analyses.

Is 4-Fluoro-3-nitrobenzoic acid (CAS: 453-71-4) safe?

4-Fluoro-3-nitrobenzoic acid can be toxic if ingested or inhaled, and skin contact should be avoided. It is classified as a hazardous material, and proper handling precautions such as wearing gloves and protective eyewear are essential. Storage should be in a well-ventilated area and away from sources of ignition. Safety data sheets (SDS) and local regulations should be consulted for detailed safety information.

How should 4-Fluoro-3-nitrobenzoic acid (CAS: 453-71-4) be stored?

4-Fluoro-3-nitrobenzoic acid should be stored in a cool, dry place, away from direct sunlight and sources of ignition. It is advisable to store it in a tightly sealed container to prevent moisture absorption. The storage temperature should be below 25°C, and the relative humidity should be kept below 60%. Adequate ventilation is necessary to prevent the buildup of flammable gases and to ensure safe handling conditions.