2,6-Dimethylbenzoic acid

Basic Information

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CAS Number

632-46-2

Molecular Formula

C9H10O2

Molecular Weight

150.18 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

115.0 to 117.0 deg-C

Boiling Point

160°C/17mmHg

Density

1.0937 (estimate)

Flash Point

126.1℃

Refractive Index

1.5236 (estimate)

SMILES

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CC1=C(C(=CC=C1)C)C(=O)O

InChI

InChI=1S/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)

InChIKey

HCBHQDKBSKYGCK-UHFFFAOYSA-N

LogP

2.00164

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

144

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

Synonyms & References

English

MFCD00002483
EN300-82114
W-104922
2,6-Dimethylbenzoic acid, 97%
BRN 1863791
FS-1055
A8723
FT-0667324
2,6-dimethyl benzoic acid
NS00035396
2,6-DiMethyl-Benzoic Acid
D2260
CHEBI:64827
632-46-2
AKOS006221869
AL-398/25017066
InChI=1/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11
EINECS 211-177-0
FT-0602126
Benzoic acid, 2,6-dimethyl-
m-Xylene-2-carboxylic Acid
Z1203161913
2,6-dimethylbenzene carboxylic acid
CL8016
SY009326
Q27133473
4,4-Diamino-3,3-dimethyldiphenylmethane
DTXSID10212551
SCHEMBL355272
2,6-DIMETHYLBENZOIC ACID
CS-W017744

MDL Number

MFCD00002483

Customs Code

29163900

FAQ

What regulatory guidelines apply to 2,6-Dimethylbenzoic acid (CAS: 632-46-2)?

2,6-Dimethylbenzoic acid (CAS: 632-46-2) is subject to various regulatory guidelines including GHS (Globally Harmonized System of Classification and Labeling of Chemicals) for hazard communication, REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) in the European Union, and FDA/EPA requirements for industrial and environmental safety. Specific regulations may vary based on local and regional laws and guidelines.

Are there alternatives to 2,6-Dimethylbenzoic acid (CAS: 632-46-2) in synthesis?

Various alternatives exist for synthesizing similar functionalities, such as 2,4-dimethylbenzoic acid or substituted benzoic acids. These can serve as effective substitutes depending on the specific needs of the synthesis, offering similar chemical reactivity but with different functional groups.

What is the market or research trend for 2,6-Dimethylbenzoic acid (CAS: 632-46-2)?

The market for 2,6-Dimethylbenzoic acid (CAS: 632-46-2) is growing due to its use in pharmaceuticals, agrochemicals, and pharmaceutical intermediates. Research trends focus on exploring its use in new drug discovery and developing more sustainable production methods. Price trends fluctuate based on supply and demand, with increasing interest in its derivatives for advanced applications.

How should waste containing 2,6-Dimethylbenzoic acid (CAS: 632-46-2) be handled?

Waste containing 2,6-Dimethylbenzoic acid (CAS: 632-46-2) should be collected in appropriate containers and disposed of through professional waste disposal services to ensure environmental safety. Incineration or other chemical treatment methods may be used, depending on local regulations. Always follow proper safety protocols and consult local hazardous waste management guidelines for specific disposal procedures.