(2,6-Dimethylphenoxy)acetic acid

Basic Information

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CAS Number

13335-71-2

Molecular Formula

C10H12O3

Molecular Weight

180.2 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

137.0 to 141.0 deg-C

SMILES

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

InChI

InChI=1S/C10H12O3/c1-7-4-3-5-8(2)10(7)13-6-9(11)12/h3-5H,6H2,1-2H3,(H,11,12)

InChIKey

MLBCURLNKYKBEQ-UHFFFAOYSA-N

LogP

1.76684

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

169

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H318 Causes serious eye damage
Serious eye damage/eye irritation

H412 Harmful to aquatic life with long lasting effects
Hazardous to the aquatic environment, long-term hazard

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

(2,6-xylyloxy) acetic acid
BB 0217644
2-(2,6-dimethylphenoxy)acetic acid
AC-1067
2,6-Dimethylphenoxyacetic acid
Acetic acid, (2,6-dimethylphenoxy)- (9CI)
CS-0120432
13335-71-2
Z56924437
Acetic acid, (2,6-dimethylphenoxy)-
Acetic acid, 2-(2,6-dimethylphenoxy)-
EC 430-910-7
MLBCURLNKYKBEQ-UHFFFAOYSA-N
2,6-dimethylphenoxy acetic acid
AS-63174
NSC408599
Acetic acid, (2,6-xylyloxy)-
HMS3604N03
FT-0654872
(2,6-DIMETHYL-PHENOXY)-ACETIC ACID
(2,6-Dimethylphenoxy)acetic acid
Acetic acid, 2-(2,6-dimethylphenoxy)-; Acetic acid, (2,6-dimethylphenoxy)- (9CI); Acetic acid, (2,6-xylyloxy)- (6CI,8CI); 2-(2,6-Dimethylphenoxy)acetic acid; (2,6-Dimethylphenoxy)acetic acid; NSC 408599
UNII-8RVEL9W5CF
2-(2,6-dimethylphenoxy)aceticacid
D4345
SCHEMBL830740
NSC-408599
LOPINAVIR IMPURITY B [WHO-IP]
NS00024282
NSC 408599
8RVEL9W5CF

MDL Number

MFCD00156912

Customs Code

2918990090

FAQ

What regulatory guidelines apply to (2,6-Dimethylphenoxy)acetic acid (CAS: 13335-71-2)?

The (2,6-Dimethylphenoxy)acetic acid (CAS: 13335-71-2) falls under the scope of GHS classification, requiring appropriate hazard communication labels and safety data sheets. In Europe, it is regulated by REACH, and in the USA, it is subject to FDA and EPA regulations for pesticide and chemical uses. Ensure compliance with local and international environmental laws and regulations.

Are there alternatives to (2,6-Dimethylphenoxy)acetic acid in synthesis (CAS: 13335-71-2)?

Alternatives to (2,6-Dimethylphenoxy)acetic acid include analogs such as 2,6-dimethoxyphenylacetic acid. Isomers like 2-methyl-6-phenylacetic acid can also be used. Common alternative reagents include 2,6-dimethylphenoxypropionic acid and related compounds. These alternatives can offer similar functionalities in synthesis while potentially offering different advantages in terms of reactivity and safety.

What is the market or research trend for (2,6-Dimethylphenoxy)acetic acid (CAS: 13335-71-2)?

The market for (2,6-Dimethylphenoxy)acetic acid is driven by its applications in agriculture and pharmaceuticals. Research trends focus on its use as a herbicide and potential for developing new formulations. The trend towards sustainable and eco-friendly alternatives is also influencing the market. Price trends show a steady demand with slight fluctuations due to supply chain disruptions and raw material costs.

How should waste containing (2,6-Dimethylphenoxy)acetic acid (CAS: 13335-71-2) be handled?

Waste containing (2,6-Dimethylphenoxy)acetic acid should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method, but ensure it is done in an environmentally controlled incinerator. For large quantities or hazardous waste, contact a hazardous waste management company. Follow local regulations and take necessary precautions to prevent environmental contamination and ensure safety during handling and disposal.