Dimethyl (2-methoxyphenoxy)malonate

Basic Information

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CAS Number

150726-89-9

Molecular Formula

C12H14O6

Molecular Weight

254.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

320.5°C at 760 mmHg

SMILES

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COC1=CC=CC=C1OC(C(=O)OC)C(=O)OC

InChI

InChI=1S/C12H14O6/c1-15-8-6-4-5-7-9(8)18-10(11(13)16-2)12(14)17-3/h4-7,10H,1-3H3

InChIKey

SBUXKADXTZOBJV-UHFFFAOYSA-N

LogP

0.7886

Topological Polar Surface Area

71.06 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

274

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

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

Synonyms & References

English

Propanedioic acid, 2-(2-methoxyphenoxy)-, 1,3-dimethyl ester
dimethyl-(2-methoxyphenoxy)malonate
dimethyl (2-methoxyphenoxy)malonate
dimethyl-2-(o-methoxyphenoxy)malonate
DTXSID80514170
BCP19459
dimethyl 2-(2-methoxyphenoxy)propanedioate
CS-D1420
dimethyl-(o-methoxyphenoxy)malonate
dimethyl (o-methoxyphenoxy)malonate
Propanedioic acid, (2-methoxyphenoxy)-, dimethyl ester
DIMETHYL 2-(2-METHOXYPHENOXY)MALONATE
DS-14101
SCHEMBL628822
AKOS015851940
150726-89-9
MFCD06797652
SY021326
SBUXKADXTZOBJV-UHFFFAOYSA-N
AC-26985
DIMETHYL 2-METHOXYPHENOXYMALONATE
J-520348
FT-0659625
Dimethyl (2-methoxyphenoxy)propanedioate
Dimethyl 2-(2-methoxyphenoxy)malonate
2-(2-Methoxyphenoxy)malonic acid dimethyl ester
Dimethyl 2-Methoxyphenoxymalonate
2-MethoxyphenoxyMalonate
Dimethyl (o-Methoxyphenoxy)malonate
DIMETHYL (2-METHOXYPHENOXY)MALONATE
Dimethyl-2-(2-methoxyphenoxy)malonate

MDL Number

MFCD06797652

Customs Code

2918990090

FAQ

What are the physical and chemical properties of Dimethyl (2-methoxyphenoxy)malonate (CAS: 150726-89-9)?

Dimethyl (2-methoxyphenoxy)malonate is a colorless to light yellow liquid. It has a molecular weight of approximately 198.22 g/mol and a density of 1.09 g/cm³. The compound is slightly soluble in water but soluble in common organic solvents like ethanol and acetone. It is moderately reactive and can undergo ester hydrolysis, making it susceptible to base-catalyzed breakdown.

How is Dimethyl (2-methoxyphenoxy)malonate (CAS: 150726-89-9) typically synthesized?

Dimethyl (2-methoxyphenoxy)malonate can be synthesized via esterification of 2-methoxyphenoxyacetic acid with dimethyl malonate. The reaction is typically catalyzed by an acid like sulfuric acid. The process involves heating the reactants under reflux to achieve a yield of about 75-85%, with selectivity towards the desired ester product.

What industries use Dimethyl (2-methoxyphenoxy)malonate (CAS: 150726-89-9)?

Dimethyl (2-methoxyphenoxy)malonate is used in various industries. It is a key intermediate in the synthesis of pharmaceuticals, particularly in the production of certain active pharmaceutical ingredients (APIs). It also finds application in the development of novel polymers and in the field of organic semiconductors for electronic devices.

What precautions should be taken when handling Dimethyl (2-methoxyphenoxy)malonate (CAS: 150726-89-9)?

When handling Dimethyl (2-methoxyphenoxy)malonate, proper personal protective equipment (PPE) should be worn, including gloves, goggles, and a lab coat. The compound should be stored in a cool, well-ventilated area away from heat sources and incompatible materials. Spills should be cleaned up using appropriate absorbent materials and disposal should follow local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and storage information.