4-Butoxyphenyl 4-hydroxybenzoate

Basic Information

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CAS Number

70568-44-4

Molecular Formula

C17H18O4

Molecular Weight

286.33 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

Density

1.169

SMILES

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CCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)O

InChI

InChI=1S/C17H18O4/c1-2-3-12-20-15-8-10-16(11-9-15)21-17(19)13-4-6-14(18)7-5-13/h4-11,18H,2-3,12H2,1H3

InChIKey

NMPRZRJMGXDQJH-UHFFFAOYSA-N

LogP

3.7903000000000033

Topological Polar Surface Area

55.760000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

302

Synonyms & References

English

SCHEMBL8211241
FT-0723216
4-Hydroxy-benzoic acid 4-butoxy-phenyl ester
(4-butoxyphenyl) 4-hydroxybenzoate
DTXSID20543106
70568-44-4
4-Butoxyphenyl4-hydroxybenzoate
4-Butoxyphenyl 4-hydroxybenzoate
4-Hydroxybenzoic acid 4-butoxyphenyl ester

MDL Number

MFCD22379980

FAQ

What are the physical and chemical properties of 4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4)?

4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4) is a white crystalline solid with a molecular weight of approximately 246.25 g/mol. It has a low solubility in water but is readily soluble in organic solvents such as ethanol and acetone. Chemically, it is stable under normal conditions but can react with strong acids or bases to form other products. It does not typically exhibit significant reactivity under normal laboratory conditions.

How is 4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4) typically synthesized?

4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4) can be synthesized via a two-step process. First, butoxybenzoic acid is converted to the corresponding ester using a standard esterification protocol. This process typically involves the use of a strong acid catalyst like concentrated sulfuric acid. Second, the product is then reacted with 4-hydroxybenzoic acid in the presence of a suitable base, such as sodium hydroxide, to form the final compound.

What industries use 4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4)?

4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4) is primarily used in the pharmaceutical industry as an intermediate in the synthesis of various drugs. It is also utilized in the cosmetic industry for its antioxidant properties and in the polymer industry as a stabilizer. Additionally, it can be found in the sensor and semiconductor industries for specialized applications.

What precautions should be taken when handling 4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4)?

When handling 4-Butoxyphenyl 4-hydroxybenzoate (CAS: 70568-44-4), it is crucial to use appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. It should be stored in a cool, dry place away from direct sunlight and heat sources. In case of a spill, it should be cleaned up carefully using appropriate disposal methods as per the safety data sheet (SDS). Always work in a well-ventilated area or a fume hood to avoid inhalation of any vapors.