4-propylphenol

Basic Information

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CAS Number

645-56-7

Molecular Formula

C9H12O

Molecular Weight

136.19 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

22°C

Boiling Point

232 °C

Density

0.983 g/mL at 25 °C

Refractive Index

n20/D 1.523(lit.)

SMILES

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CCCc1ccc(O)cc1

InChI

InChI=1S/C9H12O/c1-2-3-8-4-6-9(10)7-5-8/h4-7,10H,2-3H2,1H3

InChIKey

KLSLBUSXWBJMEC-UHFFFAOYSA-N

LogP

2.3447000000000005

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

82.7

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H332 Harmful if inhaled
Acute toxicity, inhalation

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

Hazard Class

Class 8 Class 8

Synonyms & References

English

4-n-Propylphenol
4-Propylphenol
Phenol, 4-propyl-
p-Propylphenol
3PO
4-propyl-pheno
Dihydrochavicol
FEMA 3649
Phenol,4-propyl
Phenol,p-propyl
p-n-Pr-C6H4-OH
p-n-propylphenol
p-propyl-pheno
Phenol, p-propyl-
1-Hydroxy-4-n-propylbenzene
4-Propyl-phenol
p-Hydroxypropylbenzene
Hydroxypropylbenzene, p-
FEMA No. 3649
Phenol, p-propyl-,
H27VG833JY
KLSLBUSXWBJMEC-UHFFFAOYSA-N
4-propylphenol, potassium
p-propyl-phenol
4-propyl phenol
p-hydroxyphenylpropane

MDL Number

MFCD00002395

Customs Code

29071900

FAQ

What is 4-propylphenol (CAS: 645-56-7)?

4-Propylphenol, also known as 4-Phenyl-1-butanol, is a colorless to pale yellow liquid with a characteristic odor. Its chemical formula is C9H12O. It is miscible with water and soluble in ethanol and ether. It is used in various applications including pharmaceuticals, perfumery, and as a precursor in organic synthesis.

What are the main uses of 4-propylphenol (CAS: 645-56-7)?

4-Propylphenol is widely used in the pharmaceutical industry as an intermediate for the synthesis of certain drugs. It is also used in perfumery due to its aromatic properties. Additionally, it serves as a precursor in organic synthesis for the production of other chemical compounds.

Is 4-propylphenol (CAS: 645-56-7) safe?

4-Propylphenol is generally safe when handled according to safety guidelines. However, it is flammable and may cause skin and eye irritation. Proper protective equipment, including gloves and goggles, should be used. It should be stored in a cool, dry place, away from sources of ignition and incompatible materials.

How should 4-propylphenol (CAS: 645-56-7) be stored?

4-Propylphenol should be stored in a cool, dry place with a maximum temperature of 25°C. It should be kept away from heat, sparks, and open flames. The container should be tightly sealed and stored in a well-ventilated area, away from incompatible materials such as strong oxidizers. It is important to use a suitable, non-reactive container to store this chemical to prevent any potential reactions or degradation.