4,4'-(3,4-Hexanediyl)diphenol

Basic Information

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CAS Number

5635-50-7

Molecular Formula

C18H22O2

Molecular Weight

270.37 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

234-235 ºC

SMILES

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CCC(C1=CC=C(C=C1)O)C(CC)C2=CC=C(C=C2)O

InChI

InChI=1S/C18H22O2/c1-3-17(13-5-9-15(19)10-6-13)18(4-2)14-7-11-16(20)12-8-14/h5-12,17-20H,3-4H2,1-2H3

InChIKey

PBBGSZCBWVPOOL-UHFFFAOYSA-N

LogP

4.785200000000004

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

235

Safety Information

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Hazard Class

Class 6.1(b) Class 6.1(b)

Synonyms & References

English

4,4'-(hexane-3,4-diyl)diphenol
AB00052132
NCGC00094818-04
AB00052132_08
Oprea1_380638
SBI-0051565.P002
KBio2_000967
FT-0652884
Spectrum5_001475
HMS501G05
KBioGR_000943
HMS2235O21
Esestrolo [DCIT]
NCGC00094818-03
NSC-229419
HMS1570K19
SPBio_000702
HMS1921M07
NSC757393
Hexestrol [INN:NF]
Synoestrolum
KBio2_006103
IDI1_000443
Spectrum4_000392
NCGC00094818-06
HMS3369N07
KBio1_000443
CHEMBL6615
Spectrum_000487
SR-05000001870
NCGC00094818-02

MDL Number

MFCD03755363

FAQ

What are the physical and chemical properties of 4,4'-(3,4-Hexanediyl)diphenol (CAS: 5635-50-7)?

4,4'-(3,4-Hexanediyl)diphenol (CAS: 5635-50-7) is a crystalline solid with a molecular weight of approximately 228.26 g/mol. It has a low solubility in water but is more soluble in organic solvents. Chemically, it exhibits moderate reactivity, particularly under basic conditions. It is a key intermediate in the production of polyphenols and other organic compounds.

How is 4,4'-(3,4-Hexanediyl)diphenol (CAS: 5635-50-7) typically synthesized?

4,4'-(3,4-Hexanediyl)diphenol is synthesized through the condensation of 4-hydroxybenzaldehyde with 4-hydroxybenzyl alcohol. This reaction typically requires a basic catalyst such as sodium hydroxide. The yield and selectivity are high, making it a reliable method for industrial synthesis.

What industries use 4,4'-(3,4-Hexanediyl)diphenol (CAS: 5635-50-7)?

4,4'-(3,4-Hexanediyl)diphenol is widely used in the pharmaceutical, polymer, and electronics industries. It serves as a key precursor for the synthesis of various polyphenols and is also utilized in the production of polycarbonate plastics and in the development of organic electronic materials.

What precautions should be taken when handling 4,4'-(3,4-Hexanediyl)diphenol (CAS: 5635-50-7)?

When handling 4,4'-(3,4-Hexanediyl)diphenol (CAS: 5635-50-7), it is important to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood. Spills should be cleaned up immediately using appropriate cleanup materials. Always refer to the Safety Data Sheet (SDS) for detailed safety information and guidelines.