1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene

Basic Information

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CAS Number

88074-73-1

Molecular Formula

C17H22

Molecular Weight

16.04 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

SMILES

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CCCC1CCC(CC1)C2=CC=C(C=C2)C#C

InChI

InChI=1S/CH4/h1H4

InChIKey

VNWKTOKETHGBQD-UHFFFAOYSA-N

LogP

0.6361

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

253

Synonyms & References

English

HLUVLSYQSNGSKG-UHFFFAOYSA-N
trans-4-(4'-Propylcyclohexyl)phenylacetylene
MFCD09751228
4-(4-propyl-cyclohexyl)phenyl acetylene
AKOS015917626
AC-6584
HLUVLSYQSNGSKG-JCNLHEQBSA-N
E1232
1-ETHYNYL-4-[(1S,4R)-4-PROPYLCYCLOHEXYL]BENZENE
AS-38222
trans-1-Ethynyl-4-(4-propyl-cyclohexyl)-benzene
4-(4-propyl-cyclohexyl)-phenylacetylene
1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene
88074-73-1
4-(trans-4-propylcyclohexyl)phenylacetylene
167858-58-4
4-(4-propyl-cyclohexyl)-phenyl acetylene, AldrichCPR
Benzene,1-ethynyl-4-(trans-4-propylcyclohexyl)-
C17H22
4-(4-propylcyclohexyl)phenylacetylene
benzene, 1-ethynyl-4-(4-propylcyclohexyl)-
DTXSID40937402
MFCD07784127
AKOS015917890
4-(4-propyl-cyclohexyl)-phenyl acetylene
TRANS-4-(4-PROPYLCYCLOHEXYL)-PHENYLACETYLENE
SB66582
Trans-4-(4-propylcyclohexyl)-phenyl acetylene
4-(4-Propylcyclohexy)phenylacetylene
A3717
4-(4-propylcyclohexyl)phenyl acetylene

MDL Number

MFCD09751228

FAQ

What are the physical and chemical properties of 1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene (CAS: 88074-73-1)?

1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene has a crystalline form with a molecular weight of approximately 296.43 g/mol. It is slightly soluble in common solvents like ethanol and acetone. The compound exhibits typical reactivity expected of an alkynyl benzene, including potential hydrogenation and alkyne addition reactions. It is stable under normal conditions but should be stored in a cool, dry place away from direct sunlight.

How is 1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene (CAS: 88074-73-1) typically synthesized?

1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene is usually synthesized via Grignard reaction followed by alkylation. The synthesis involves reacting a trans-4-propylcyclohexyl Grignard reagent with ethyne in the presence of a suitable solvent and a mild base. The process yields a high selectivity and good yield, with minimal by-products.

What industries use 1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene (CAS: 88074-73-1)?

1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene is used in the pharmaceutical industry for the synthesis of certain drug molecules. It is also utilized in the polymer industry for the development of novel polymer materials with specific mechanical properties. Additionally, it has applications in the sensor industry due to its unique chemical functionality.

What precautions should be taken when handling 1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene (CAS: 88074-73-1)?

When handling 1-Ethynyl-4-(trans-4-propylcyclohexyl)benzene, it is important to use appropriate Personal Protective Equipment (PPE), including gloves, goggles, and a lab coat. It should be stored in a well-ventilated area and used with a fume hood to minimize exposure. In case of spill, absorb with paper towels and dispose of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.