1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate}

Basic Information

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CAS Number

32509-66-3

Molecular Formula

C50H66O8

Molecular Weight

795.07 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

802.7ºC at 760mmHg

Density

1.119g/cm3

Flash Point

221.9ºC

Refractive Index

1.56

SMILES

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CC(C)(C)C1=C(C=CC(=C1)C(C)(CC(=O)OCCOC(=O)CC(C)(C2=CC(=C(C=C2)O)C(C)(C)C)C3=CC(=C(C=C3)O)C(C)(C)C)C4=CC(=C(C=C4)O)C(C)(C)C)O

InChI

InChI=1S/C50H66O8/c1-45(2,3)35-25-31(15-19-39(35)51)49(13,32-16-20-40(52)36(26-32)46(4,5)6)29-43(55)57-23-24-58-44(56)30-50(14,33-17-21-41(53)37(27-33)47(7,8)9)34-18-22-42(54)38(28-34)48(10,11)12/h15-22,25-28,51-54H,23-24,29-30H2,1-14H3

InChIKey

JOWXNCPELQZFHF-UHFFFAOYSA-N

LogP

10.877799999999988

Topological Polar Surface Area

133.52 Å²

Hydrogen Bond Donor/Acceptor

4 / 8

Complexity

1170

Synonyms & References

English

BUTYRIC ACID, 3,3-BIS(3-TERT-BUTYL-4- HYDROXYPHENYL)ETHYLENE ESTER
32509-66-3
FT-0626302
ethylene bis[3,3-bis(3-t-butyl-4-hydroxyphenyl)butyrate)
EINECS 251-073-2
2-[3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoyloxy]ethyl 3,3-bis(3-tert-butyl-4-hydroxyphenyl)butanoate
EC 251-073-2
Hostanox 03
UNII-2IRE6XVP1D
1,2-ETHANEDIYL BIS(3,3-BIS(3-TERT-BUTYL-4-HYDROXYPHENYL)BUTANOATE)
3,3-BIS(3-TERT-BUTYL-4-HYDROXYPHENYL)ETHYLENE BUTYRATE
ethylene bis(3,3-bis(3(1,1-dimethylethyl)-4-hydroxy-phenyl) butanoate)
Ethylene(3,3-bis-(3-(1,1-dimethylethyl)-4-hydroxyphenyl)butanoate
W-110820
SCHEMBL39426
PLASTIC ADDITIVE 1 [USP-RS]
3-((3,3-Bis(3-(tert-butyl)-4-hydroxyphenyl)butanoyl)oxy)propyl 3-(4-(tert-butyl)-3-hydroxyphenyl)-3-(3-(tert-butyl)-4-hydroxyphenyl)butanoate
ETHYLENE 3,3-BIS(3-TERT-BUTYL-4-HYDROXYPHENYL)BUTYRATE
BENZENEPROPANOIC ACID, 3-(1,1-DIMETHYLETHYL)-.BETA.-(3-(1,1- DIMETHYLETHYL)-4-HYDROXYPHENYL)-4-HYDROXY-.BETA.-METHYL-, 1,2- ETHANEDIYL ESTER
Benzenepropanoic acid, 3-(1,1-dimethylethyl)-.beta.-[3-(1,1-dimethylethyl)-4-hydroxyphenyl]-4-hydroxy-.beta.-methyl-, 1,2-ethanediyl ester
DTXSID9052006
2IRE6XVP1D
Benzenepropanoic acid, 3-(1,1-dimethylethyl)-beta-(3-(1,1-dimethylethyl)-4-hydroxyphenyl)-4-hydroxy-beta-methyl-, 1,1'-(1,2-ethanediyl) ester
Ethylene bis(3,3-bis(3-tert-butyl-4-hydroxyphenyl)butyrate)
ethylene bis[3,3-bis(3-tert-butyl-4-hydroxyphenyl)butyrate]
Plastic additive 08, European Pharmacopoeia (EP) Reference Standard
PLASTIC ADDITIVE 1
Benzenepropanoic acid, 3-(1,1-dimethylethyl)-beta-(3-(1,1-dimethylethyl)-4-hydroxyphenyl)-4-hydroxy-beta-methyl-, 1,2-ethanediyl ester
Hostanox O 3
ETHYLENE GLYCOL BIS(.BETA.,.BETA.-BIS(3-TERT-BUTYL-4-HYDROXYPHENYL)BUTYRATE)
ethylene bis(3,3-bis(3(1,1-dimethylethyl)-4-hydroxy-phenyl)butanoate)

MDL Number

MFCD09838471

FAQ

What are the physical and chemical properties of 1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3)?

The compound 1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3) is a white to light yellow crystalline solid with a high molecular weight. It has poor water solubility but good solubility in organic solvents. The compound is characterized by its stability and low reactivity under normal conditions, making it suitable for various applications in the chemical industry.

How is 1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3) typically synthesized?

1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3) is synthesized via a multi-step process involving the condensation of 4-hydroxy-3-(2-methyl-2-propanyl)benzoic acid with bis(3-bromopropyl) carbonate. The reaction is typically carried out under dehydrating conditions using anhydrous solvents, with the use of a catalyst to enhance the reaction yield and selectivity.

What industries use 1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3)?

1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3) is primarily used in the pharmaceutical industry for the synthesis of derivatives and prodrugs. It is also employed in the polymer industry as a monomer for the development of novel materials. Additionally, it finds applications in the production of sensors and semiconductors due to its unique physical and chemical properties.

What precautions should be taken when handling 1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3)?

When handling 1,2-Ethanediyl bis{3,3-bis[4-hydroxy-3-(2-methyl-2-propanyl)phenyl]butanoate} (CAS: 32509-66-3), it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. Ensure the work is carried out in a well-ventilated area, preferably in a fume hood. In case of a spill, follow standard safety protocols and refer to the Safety Data Sheet (SDS) for specific guidance on cleanup procedures.