2-Nitro-4-(trifluoromethyl)benzoic acid

Basic Information

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CAS Number

320-94-5

Molecular Formula

C8H4F3NO4

Molecular Weight

235.12 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

Basic Physical Properties

Melting Point

135.0 to 139.0 deg-C

Boiling Point

306.6°C at 760 mmHg

Density

1.5960

SMILES

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

InChI

InChI=1S/C8H4F3NO4/c9-8(10,11)4-1-2-5(7(13)14)6(3-4)12(15)16/h1-3H,(H,13,14)

InChIKey

MYSAXQPTXWKDPQ-UHFFFAOYSA-N

LogP

2.83500

Complexity

299

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

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

SCHEMBL13079030
AC-4002
benzoic acid, 2-nitro-4-(trifluoromethyl)-
alpha,alpha,alpha-Trifluoro-2-nitro-p-toluic acid
SCHEMBL442397
2-Nitro-4-trifluoromethyl-benzoic acid
4-trifluoromethyl-2-nitrobenzoic acid
N0720
K9M35SV4P3
.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-2-NITRO-P-TOLUIC ACID
FT-0613161
TD1064
C8H4F3NO4
EN300-75245
2-Nitro-4-trifluoromethyl benzoic acid
NTFA
UNII-K9M35SV4P3
4-(trifluoromethyl)-2-nitrobenzoic acid
1J-350S
P-TOLUIC ACID, .ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-2-NITRO-
2-nitro-4-(trifluoromethyl)benzoic acid
2-Nitro-4-(trifluoromethyl)benzoic acid, 98%
AM20060240
J-018629
AKOS005063816
InChI=1/C8H4F3NO4/c9-8(10,11)4-1-2-5(7(13)14)6(3-4)12(15)16/h1-3H,(H,13,14
2-nitro-4-triflouromethyl-benzoic acid
320-94-5
F0001-2470
Q27282134
p-Toluic acid, alpha,alpha,alpha-trifluoro-2-nitro-

MDL Number

MFCD00007142

Customs Code

2916399090

FAQ

What is 2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5)?

2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5) is an organic compound with the molecular formula C8H4F3NO3. It is a white crystalline solid with a pungent odor. This compound has a melting point of 167-168°C and is soluble in water and most organic solvents.

What are the main uses of 2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5)?

2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5) is primarily used in the synthesis of pharmaceuticals, particularly in the development of drugs targeting various diseases. It is also employed in the production of dyes, pesticides, and as a reagent in organic chemistry research.

Is 2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5) safe?

2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5) is generally considered safe when handled with proper precautions. However, it can cause skin irritation and eye irritation. It is important to use appropriate personal protective equipment (PPE) such as gloves and goggles during handling. Inhalation of the compound should be avoided, and it should be stored in a well-ventilated area.

How should 2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5) be stored?

2-Nitro-4-(trifluoromethyl)benzoic acid (CAS: 320-94-5) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in tightly sealed containers to prevent moisture absorption. The storage area should be well-ventilated and isolated from incompatible substances, such as reducing agents and strong bases. Avoid contact with oxidizing agents and ensure good air circulation.