THIOCINEOLE - CAS 5718-75-2

THIOCINEOLE is a chiral auxiliary that are temporarily added to organic synthesis reactions to induce chirality in one or more steps of a synthetic route.

Catalog Number

5718-75-2

CAS

5718-75-2

IUPAC Name

(1R,4R,5R)-4,7,7-trimethyl-6-thiabicyclo[3.2.1]octane

Synonyms

(+/-)-2,8-EPITHIO-CIS-P-MENTHANE; 4,7,7-TRIMETHYL-6-THIABICYCLO(3.2.1)OCTANE; FEMA 4108; THIOCINEOLE; exo-(-)-4,7,7-trimethyl-6-thiabicyclo[3.2.1]octane; Thiocineolefemano.; (1R,4R,5R)-4,7,7-Trimethyl-6-thiabicyclo[3.2.1]octane

Molecular Weight

170.31

Molecular Formula

C10H18S

Product Information

Canonical SMILES

CC1CCC2CC1SC2(C)C

InChI

InChI=1S/C10H18S/c1-7-4-5-8-6-9(7)11-10(8,2)3/h7-9H,4-6H2,1-3H3/t7-,8-,9-/m1/s1

InChI Key

FAXNZPOZWCWYBD-IWSPIJDZSA-N

Purity

>95.0%(GC)

Physical State

Liquid

Boiling Point

84 °C / 5 mmHg

Flash Point

79 °C

Optical Activity

-70° (c=1.32 in chloroform)

Refractive Index

1.52

Safety Information

Signal Word

Warning

Precautionary Statement

P501 - P210 - P280 - P370+P378 - P403+P235

Hazard Statements

H227

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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THIOCINEOLE - CAS 5718-75-2

Product Information

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