[2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite

Identification

Molecular formula

C₁₈H₂₆O₃S

CAS number

141625-72-3

IUPAC name

[2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite

State

At room temperature, this compound is a liquid, often used in various chemical syntheses and modifications.

Melting point (Celsius)

-12.30

Melting point (Kelvin)

260.85

Boiling point (Celsius)

321.40

Boiling point (Kelvin)

594.55

General information

Molecular weight

314.47g/mol

Molar mass

314.4470g/mol

Density

0.9184g/cm³

Appearence

The compound is typically a colorless to pale yellow liquid. It may exhibit a slight aromatic odor typical of organic sulfites.

Comment on solubility

Solubility of [2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite

The compound [2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite with the chemical formula C₁₈H₂₆O₃S presents an interesting case concerning its solubility characteristics.

In general, the solubility of organic compounds like sulfites can be influenced by several factors, including:

Molecular structure: The presence of hydrophobic groups, such as the tert-butyl moiety, may decrease water solubility.
Polarity: The overall polarity of the molecule, dictated by functional groups and their arrangements, plays a crucial role in determining how well it dissolves in polar or nonpolar solvents.
Temperature: As with many organic compounds, increased temperature often enhances solubility due to increased kinetic energy of the molecules.

Specific solubility data for this compound may be limited, but it can be inferred that:

It may exhibit moderate solubility in organic solvents like ethanol or acetone.
Due to its significant carbon content and branching structures, it is less likely to be soluble in water.
The presence of the sulfite functional group suggests potential interactions with polar solvents, though these are likely overshadowed by hydrophobic characteristics.

In summary, while precise solubility data is not readily available, understanding the interplay of molecular structure and solvent characteristics can provide valuable insights into the solubility behavior of [2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite.

Interesting facts

Interesting Facts about [2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite

[2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite is a fascinating compound that bridges the realms of organic chemistry and materials science. This compound belongs to a class of organosulfur compounds, which are remarkably diverse and exhibit unique properties owing to their sulfur atom.

Key Features and Applications:

Functional Group Versatility: The compound contains both a sulfite group and a propyne moiety, which allows for interesting chemical reactivity and potential applications in synthesis.
Phenoxy Group Influence: The presence of the 4-tert-butylphenoxy group can enhance the solubility and stability of this compound, influencing its physical properties. This aspect is particularly valuable when considering its use in various formulations.
Potential Uses: With its distinctive molecular structure, this compound may serve as a precursor in the production of specialty polymers or as an additive in coatings and adhesives.

Additionally, organosulfur chemistry is known for its role in various fields, including pharmaceuticals and agrochemicals. As a chemist, you might appreciate the potential of sulfite derivatives in green chemistry, where developing environmentally friendly chemical processes is paramount. The anticipation of discovering new properties through further research can inspire and drive innovation in related industries.

As a notable quote in the field states, "The most exciting breakthroughs of the 21st century will not occur because of technology, but because of an expanding understanding of basic biology." While this quote pertains to biology, it reflects a similar excitement in chemistry where understanding complex compounds can lead to revolutionary advancements. Discovering how [2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite interacts with other substances could be the key to unlocking new technologies and applications.

Synonyms

propargite

2312-35-8

OMITE

Comite

2-(4-(tert-Butyl)phenoxy)cyclohexyl prop-2-yn-1-yl sulfite

BPPS

Cyclosulfyne

Omait

Uniroyal D014

Omite 57E

Omite 85E

2-(p-tert-Butylphenoxy)cyclohexyl propargyl sulfite

2-(p-tert-Butylphenoxy)cyclohexyl 2-propynyl sulfite

Propargite [ISO]

2-(4-tert-Butylphenoxy)cyclohexyl prop-2-ynyl sulfite

[2-(4-tert-butylphenoxy)cyclohexyl] prop-2-ynyl sulfite

2-(p-t-Butylphenoxy)cyclohexyl propargyl sulfite

Propargil

2-(4-tert-Butylphenoxy)cyclohexyl prop-2-ynyl sulphite

DTXSID4024276

DO 14

D 014

ENT 27226

Naugatuck D 014

30M429ANKL

CHEBI:39300

COMITE II

Sulfurous acid, 2-(p-tert-butylphenoxy)cyclohexyl 2-propynyl ester

PROPARGITE [MI]

2-(4-tert-butylphenoxy)cyclohexyl prop-2-yn-1-yl sulfite

OMITE [HSDB]

2-(4-(1,1-Dimethylethyl)phenoxy)cyclohexyl 2-propynyl sulfurous acid

Sulfurous acid, 2-(4-(1,1-dimethylethyl)phenoxy)cyclohexyl 2-propynyl ester

DTXCID304276

2-(4-(1,1-Dimethylethyl)phenoxy)cyclohexyl 2-propynyl sulfite

Sulfurous acid, 2-[4-(1,1-dimethylethyl)phenoxy]cyclohexyl 2-propyn-1-yl ester

Propargite 100 microg/mL in Isooctane

Propargite 10 microg/mL in Acetonitrile

Sulfurous acid, 2-[4-(1,1-dimethylethyl)phenoxy]cyclohexyl 2-propynyl ester

Naugatuck D-014

Caswell No. 130I

omite-CR

U.S. Rubber D-014

SULFUROUS ACID, 2-(4-(1,1-DIMETHYLETHYL)PHENOXY)CYCLOHEXYL 2-PROPYN-1-YL ESTER

CAS-2312-35-8

Propargite [ANSI:BSI:ISO]

HSDB 1528

2-(4-tert-Butylphenoxy)cyclohexyl 2-propynyl sulfite

EINECS 219-006-1

EPA Pesticide Chemical Code 097601

UNII-30M429ANKL

AI3-27226

Omite rho

SULFUROUS ACID, 2-(4-(1,1-DIMETHYLETHYL)PHENOXY) CYCLOHEXYL 2-PROPYNYL ESTER

SULFUROUS ACID, 2-[4-(1,1-DIMETHYLETHYL)PHENOXY] CYCLOHEXYL 2-PROPYNYL ESTER

Naugatuck D014

KELARAN

Spectrum_001925

SpecPlus_000556

2-(4-(1,1-Dimethylethyl)phenoxy)cyclohexyl-2-propynyl sulfite

NAUGATUCK DO 14

Spectrum2_001875

Spectrum3_000858

Spectrum4_000698

Spectrum5_002034

U.S. Rubber D014

EC 219-006-1

SCHEMBL15358

BSPBio_002475

KBioGR_001195

KBioSS_002467

SPECTRUM330067

DivK1c_006652

SPBio_001750

2-(4-tert-butylphenoxy)cyclohexyl-2-propynyl sulfite

CHEMBL1416084

KBio1_001596

KBio2_002460

KBio2_005028

KBio2_007596

KBio3_001975

HY-B2028

MSK25027

Tox21_202046

Tox21_300805

CCG-39413

Sulfurous acid, 2-(p-tert-butylphenoxy)cyclohexyl-2-propynyl ester

AKOS007930242

USEPA/OPP Pesticide Code: 97601

DS-2860

ENT 27,226

FP39330

NCGC00094545-01

NCGC00094545-02

NCGC00094545-03

NCGC00094545-04

NCGC00094545-05

NCGC00094545-06

NCGC00094545-07

NCGC00254709-01

NCGC00259595-01

AC-12687

DB-046075

2(ptButylphenoxy)cyclohexyl propargyl sulfite

CS-0014126

NS00006783

2(ptertButylphenoxy)cyclohexyl propargyl sulfite

C18602

2(4tertButylphenoxy)cyclohexyl prop2ynyl sulfite

2(4tertButylphenoxy)cyclohexyl prop2ynyl sulphite

2(ptertButylphenoxy)cyclohexyl 2propynyl sulfite

Q168065

2-(p-tert-Butylphenoxy)cyclohexyl 2'-propynyl sulfite

2(4(1,1Dimethylethyl)phenoxy)cyclohexyl2propynyl sulfite

2-(4-tert-Butylphenoxy)cyclohexyl 2-propynyl sulfite #

2-(Para-tert-butylphenoxy)cyclohexyl-2'-propynyl sulfite

2(4(1,1Dimethylethyl)phenoxy)cyclohexyl 2propynyl sulfite

Sulfurous acid, 2(ptertbutylphenoxy)cyclohexyl 2propynyl ester

2(4(1,1Dimethylethyl)phenoxy)cyclohexyl 2propynyl sulfurous acid

Sulfurous acid, 2(4(1,1dimethylethyl)phenoxy)cyclohexyl 2propynyl ester

219-006-1

Pesticide5_Propargite_C19H26O4 S_Sulfurous acid, 2-[4-(1,1-dimethylethyl)phenoxy]cyclohexyl 2-propyn-1-yl ester