4-Cyanophenyl 4-pentylbenzoate

Basic Information

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CAS Number

49763-64-6

Molecular Formula

C19H19NO2

Molecular Weight

293.4 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C#N

InChI

InChI=1S/C19H19NO2/c1-2-3-4-5-15-6-10-17(11-7-15)19(21)22-18-12-8-16(14-20)9-13-18/h6-13H,2-5H2,1H3

InChIKey

WCCDNUMASFDPFO-UHFFFAOYSA-N

LogP

4.51018

Complexity

382

Synonyms & References

English

4-Cyanophenyl-4'-N-pentylbenzoate
4'-Cyanophenyl 4-pentylbenzoate
DTXSID6068519
4-Cyanophenyl-4-n-pentylbenzoate
A827843
4-(n-bentyl)benzoic acid-4'-cyanophenol ester
(4-cyanophenyl) 4-pentylbenzoate
EINECS 256-477-2
F71339
SCHEMBL4652053
NS00031963
FT-0704668
49763-64-6
MFCD00101500
4-cyanophenyl 4-pentylbenzoate
p-Cyanophenyl p-pentylbenzoate
AKOS015917694
W-106007
Benzoic acid, 4-pentyl-, 4-cyanophenyl ester
4-pentyl-benzoic acid 4-cyano-phenyl ester
4-Cyanophenyl 4-pentylbenzoate
4-cyanopheny 4-pentylbenzoate
p'-cyanophenyl-p-n-pentylbenzoate
p-n-pentylbenzoic acid p'-cyanophenyl ester

MDL Number

MFCD00101500

Customs Code

2926909090

FAQ

What is 4-Cyanophenyl 4-pentylbenzoate (CAS: 49763-64-6)?

4-Cyanophenyl 4-pentylbenzoate is a chemical compound with the CAS number 49763-64-6. It is a phenyl-substituted benzoate derivative featuring a cyanophenyl group and a pentyl chain. This compound is colorless or white crystalline solid with a pungent odor. It is insoluble in water but soluble in organic solvents like ethanol and acetic acid.

What are the main uses of 4-Cyanophenyl 4-pentylbenzoate (CAS: 49763-64-6)?

4-Cyanophenyl 4-pentylbenzoate is primarily used as a raw material in the pharmaceutical industry for the synthesis of other compounds. It also finds applications in the research field for studying metabolic pathways and as a tool compound. Additionally, it can be utilized in the synthesis of dyes and other organic compounds.

Is 4-Cyanophenyl 4-pentylbenzoate (CAS: 49763-64-6) safe?

4-Cyanophenyl 4-pentylbenzoate (CAS: 49763-64-6) is generally safe when handled with proper precautions. It is important to avoid skin contact and inhalation of dust or fumes. Protective measures include the use of gloves, goggles, and appropriate respiratory protection. It is not considered a significant health hazard but can cause irritation. Always follow safety data sheet (SDS) guidelines for handling.

How should 4-Cyanophenyl 4-pentylbenzoate (CAS: 49763-64-6) be stored?

4-Cyanophenyl 4-pentylbenzoate (CAS: 49763-64-6) should be stored in a cool, dry place away from direct sunlight and heat sources. The storage container should be tightly sealed to prevent moisture absorption. It is advisable to store it in a fume hood or a well-ventilated area to minimize exposure to air and potential degradation. Ensure the container is made of appropriate material, such as glass or metal, to prevent chemical reactions with the container.