5-Amino-2-methylbenzoic acid

Basic Information

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CAS Number

2840-04-2

Molecular Formula

C8H9NO2

Molecular Weight

151.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Physical State

Light Brown

Melting Point

194-199 °C

Boiling Point

348.8±30.0 °C(Predicted)

Density

1.254±0.06 g/cm3(Predicted)

Flash Point

164.7°C

Solubility

DMSO (Slightly), Ethyl acetate (Very Slightly, Heated)

Refractive Index

1.618

SMILES

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CC1=C(C=C(C=C1)N)C(=O)O

InChI

InChI=1S/C8H9NO2/c1-5-2-3-6(9)4-7(5)8(10)11/h2-4H,9H2,1H3,(H,10,11)

InChIKey

FSXVZWAWYKMFMX-UHFFFAOYSA-N

LogP

1.27542

pKa

2.95±0.25(Predicted)

Topological Polar Surface Area

63.32000000000001 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

158

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

J-516701
FT-0647657
SY031003
2-METHYL-5-AMINOBENZOIC ACID
5-Amino-o-toluic acid
TS-01990
A819436
AM20060596
5-amino-2-methylbenzoic acid
3-amino-6-methylbenzoic acid
5-Amino-2-methylbenzoicacid
Benzoic acid, 5-amino-2-methyl-
EN300-71984
CS-W003272
SB36370
BCP24537
DS-0415
J-017058
Z802851852
5-Amino-2-methyl-benzoic acid
DTXSID10438815
2840-04-2
AC-056
5-azanyl-2-methyl-benzoic acid
AKOS009334299
5-Amino-2-methyl benzoic acid
SCHEMBL2323573
5-Amino-2-methylbenzoic acid, 97%
FSXVZWAWYKMFMX-UHFFFAOYSA-N
2-Methyl-5-amino benzoic acid
MFCD06208351

MDL Number

MFCD06208351

Customs Code

29224999

FAQ

What regulatory guidelines apply to 5-Amino-2-methylbenzoic acid (CAS: 2840-04-2)?

5-Amino-2-methylbenzoic acid (CAS: 2840-04-2) must comply with the Globally Harmonized System (GHS) for classification and labeling of chemicals. Additionally, it is subject to the Registration, Evaluation, Authorization and Restriction of Chemicals (REACH) regulations in the European Union. In the United States, it is regulated by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) for industrial and pharmaceutical applications.

Are there alternatives to 5-Amino-2-methylbenzoic acid (CAS: 2840-04-2) in synthesis?

Alternatives to 5-Amino-2-methylbenzoic acid include 4-Amino-2-methylbenzoic acid and 6-Amino-2-methylbenzoic acid. Commonly used reagents like 2-methylbenzoyl chloride and aniline can be used to synthesize similar compounds, providing flexibility in chemical synthesis.

What is the market or research trend for 5-Amino-2-methylbenzoic acid (CAS: 2840-04-2)?

The market for 5-Amino-2-methylbenzoic acid is driven by its use in pharmaceuticals, particularly in the synthesis of certain drugs. Research trends focus on its application in anti-inflammatory and antiviral drugs. Emerging studies also explore its potential in agrochemicals and as a precursor in organic synthesis.

How should waste containing 5-Amino-2-methylbenzoic acid (CAS: 2840-04-2) be handled?

Waste containing 5-Amino-2-methylbenzoic acid should be collected in appropriate waste containers and stored separately. It should be disposed of through an authorized waste disposal service that specializes in chemical waste. Incineration under controlled conditions is a common method, and environmental protection measures should be followed to prevent contamination of water and soil.