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2-Methyl-2-propanyl 4-methylbenzoate(CAS: 13756-42-8)

2-Methyl-2-propanyl 4-methylbenzoate
CAS Number

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Basic Information

Molecular Formula
C12H16O2
Molecular Weight
192.26 g/mol

Physical Properties

Boiling Point
256°C
Flash Point
112.237°C

Chemical Identifiers

SMILES
CC1=CC=C(C=C1)C(=O)OC(C)(C)C
InChIKey
GRUSXPIAJWRLRQ-UHFFFAOYSA-N

Database References

MDL Number
MFCD06795961

FAQ

2-Methyl-2-propanyl 4-methylbenzoate (CAS: 13756-42-8) is a crystalline solid with a molecular weight of approximately 210.27 g/mol. It has a low solubility in water but is more soluble in organic solvents like ethanol and acetone. Chemically, it is relatively stable but can undergo hydrolysis under basic conditions. It has a melting point of around 55-57°C and a boiling point of about 245-247°C.
2-Methyl-2-propanyl 4-methylbenzoate can be synthesized by esterification of 4-methylbenzoic acid with 2-methyl-2-propanol. Commonly, this is achieved using sulfuric acid as a catalyst in an esterification reaction. The process requires careful control of temperature and reaction time to achieve high yield and selectivity.
2-Methyl-2-propanyl 4-methylbenzoate (CAS: 13756-42-8) is primarily used in the pharmaceutical industry as an intermediate for drug synthesis. It also finds applications in the polymer industry for certain monomer formulations. Additionally, it can be used in the production of some fragrance and flavor compounds, as well as in analytical chemistry for specific reagent applications.
When handling 2-Methyl-2-proanyl 4-methylbenzoate (CAS: 13756-42-8), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. It should be stored in a cool, dry place away from direct sunlight and heat sources. Handling should be conducted in a well-ventilated area or a fume hood. In case of a spill, it should be cleaned up using appropriate absorbent materials and the material safety data sheet (MSDS) should be consulted for specific disposal procedures.

Safety Notice

Please verify product specifications and safety data before use. Contact the supplier for detailed safety information.

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