4-N-Pentylphenylacetylene

Basic Information

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CAS Number

79887-10-8

Molecular Formula

C13H16

Molecular Weight

16.04 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Physical Properties

Boiling Point

172 °C

Density

0.885 g/mL at 25 °C

Refractive Index

n20/D 1.523(lit.)

SMILES

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CCCCCC1=CC=C(C=C1)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

164

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Sensitiveness

Light Sensitive

Synonyms & References

English

1-Ethynyl-4-pentylbenzene, 97%
FT-0641736
P-ETHYNYLPENTYLBENZENE
4-(Pent-1-yl)phenylacetylene
4-n-pentyl phenylacetylene
MFCD00173884
Benzene, 1-ethynyl-4-pentyl-
SY046417
79887-10-8
A839779
E0563
J-504623
1-Eth-1-ynyl-4-pentylbenzene
AS-15116
4-n-Pentylphenylacetylene
1-Ethynyl-4-pentylbenzene
4-pentylphenyl acetylene
4-Pentylphenylacetylene
4-Amylphenylacetylene
4-Ethynylpentylbenzene
(4-pentylphenyl)acetylene
CS-W017589
BCP21815
APGNXGIUUTWIRE-UHFFFAOYSA-N
4-n-Pentylphenylacetylene; 4-Pentylphenylacetylene; 1-ethynyl-4-pentyl-benzene; 1-Eth-1-ynyl-4-pentylbenzene
DTXSID80379403
CHEBI:189254
AKOS005146091
p-Ethynylpentylbenzene
1-Ethynyl-4-fluorobenzene
1-ETHYNYL-4-N-AMYLBENZENE

MDL Number

MFCD00173884

Customs Code

2902909090

FAQ

What is 4-N-Pentylphenylacetylene (CAS: 79887-10-8)?

4-N-Pentylphenylacetylene (CAS: 79887-10-8) is an organic compound with the molecular formula C13H16. It is a colorless to light yellow liquid with a distinctive odor. This compound has a low melting point and is volatile. It is used in various applications including pharmaceuticals, industrial chemicals, and research.

What are the main uses of 4-N-Pentylphenylacetylene (CAS: 79887-10-8)?

4-N-Pentylphenylacetylene (CAS: 79887-10-8) is primarily used in the synthesis of other organic compounds, as a precursor in pharmaceuticals, and in the production of dyes and pigments. It is also utilized in polymer chemistry and as a solvent in research settings.

Is 4-N-Pentylphenylacetylene (CAS: 79887-10-8) safe?

4-N-Pentylphenylacetylene (CAS: 79887-10-8) is generally safe when handled with proper precautions. It is flammable and should be stored away from heat sources and open flames. Protective equipment such as gloves and goggles should be worn during handling to prevent skin and eye contact.

How should 4-N-Pentylphenylacetylene (CAS: 79887-10-8) be stored?

4-N-Pentylphenylacetylene (CAS: 79887-10-8) should be stored in a cool, dry place away from heat sources and open flames. It should be kept in a tightly sealed container and protected from light. The storage area should have good ventilation to prevent the accumulation of flammable vapors.