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4-(2-Hydroxyethyl)cyclohexanol (cis- and trans- mixture)

4-(2-Hydroxyethyl)cyclohexanol (cis- and trans- mixture)

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Molecular Formula:

C8H16O2

Molecular Weight:

144.21

CAS Number:

74058-21-2

Catalog Number:

74058-21-2

Product Information

Molecular Formula:

C8H16O2

Molecular Weight:

144.21

Description

4-(2-Hydroxyethyl)cyclohexanol (cis- and trans- mixture) is a versatile compound widely used in the biomedical industry. It serves as a valuable intermediate in the synthesis of various drugs, such as analgesics, anti-inflammatories, and antivirals.

Synonyms

2-(4-Hydroxycyclohexyl)ethanol (cis- and trans- mixture)||||4-Hydroxycyclohexaneethanol (cis- and trans- mixture)

IUPAC Name

4-(2-hydroxyethyl)cyclohexan-1-ol

Canonical SMILES

C1CC(CCC1CCO)O

InChI

InChI=1S/C8H16O2/c9-6-5-7-1-3-8(10)4-2-7/h7-10H,1-6H2

InChI Key

SZIBVWWQOOVXHS-UHFFFAOYSA-N

Boiling Point

175 °C / 20mmHg

Purity

>98.0%(GC)

Density

1.05

Appearance

Colorless to Almost colorless clear liquid

Refractive Index

1.4900-1.4940

Computed Properties

XLogP3

0.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

144.115029749 g/mol

Monoisotopic Mass

144.115029749 g/mol

Topological Polar Surface Area

40.5Å²

Heavy Atom Count

Formal Charge

Complexity

85.3

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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4-(2-Hydroxyethyl)cyclohexanol (cis- and trans- mixture)

Product Information

Computed Properties

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