4-(4-Pyridinyl)-1-butanol

Basic Information

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CAS Number

5264-15-3

Molecular Formula

C9H13NO

Molecular Weight

151.21 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Boiling Point

290.9°C at 760 mmHg

Density

1.035

Flash Point

290.9 °C at 760 mmHg

SMILES

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C1=CN=CC=C1CCCCO

InChI

InChI=1S/C9H13NO/c11-8-2-1-3-9-4-6-10-7-5-9/h4-7,11H,1-3,8H2

InChIKey

HFGNRLFZUNCBPF-UHFFFAOYSA-N

LogP

1.3965999999999998

Topological Polar Surface Area

33.120000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

89.6

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

Synonyms & References

English

SY008209
4-Pyridin-4-yl-butan-1-ol
SB52619
HFGNRLFZUNCBPF-UHFFFAOYSA-N
4-pyridinebutanol
4-(Pyridin-4-yl)butan-1-ol;4-(4-Pyridyl)-1-butanol
4-(4-pyridinyl)-1-butanol
CS-0028752
BCP33372
FT-0660776
SCHEMBL4444401
4-pyridin-4-yl-butan-1-ol, AldrichCPR
4-(4-pyridyl)-butan-1-ol
A-Pyridyl)butanol
4-(4-Pyridyl)-1-butanol
AS-10514
BB 0218121
MFCD03265696
5264-15-3
4-(4-Pyridinyl)butanol
4-pyridin-4-ylbutan-1-ol
4-(Pyridin-4-yl)butan-1-ol
4-(4-hydroxybutyl)pyridine
AC-8870
4-(
DTXSID40382791
AKOS000365757
4-pyridinebutanol ,4-PYRIDIN-4-YL-BUTAN-1-OL
AURORA KA-2522
4-(4-Pyridinyl)-1-butanol
4-Pyridinebutane-1-ol

MDL Number

MFCD03265696

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3)?

4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3) is a colorless liquid with a molecular weight of approximately 147.16 g/mol. It has a pKa of about 14.2 and exhibits moderate solubility in water (0.5 g/100 mL at 20°C). This compound is poorly soluble in nonpolar solvents. It is moderately reactive towards nucleophiles and can form complexes with various metal ions. The compound is crystalline at lower temperatures and has a melting point of 108-109°C.

How is 4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3) typically synthesized?

4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3) is typically synthesized via the condensation of 4-pyridinecarboxaldehyde with 1-butanol using a base like potassium hydroxide as a catalyst. The reaction is carried out in a non-aqueous solvent such as acetonitrile at room temperature. The yield is generally around 70-80%, and the reaction is highly selective, making it a reliable method for obtaining the desired product.

What industries use 4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3)?

4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3) is primarily used in the pharmaceutical industry for the synthesis of pharmaceutical intermediates and as a chelating agent in metal-based drugs. It also finds applications in the polymer industry as a modifying agent and in the development of sensors and semiconductors for its unique physicochemical properties.

What precautions should be taken when handling 4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3)?

When handling 4-(4-Pyridinyl)-1-butanol (CAS: 5264-15-3), it is important to use appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to prevent inhalation of vapors. Spills should be cleaned up immediately using appropriate absorbent materials and following standard safety protocols. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.