1-Acetyl-4-piperidinecarbonyl chloride

Basic Information

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CAS Number

59084-16-1

Molecular Formula

C8H12ClNO2

Molecular Weight

189.64 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

Melting Point

135-137°C

Density

1.224

SMILES

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CC(=O)N1CCC(CC1)C(=O)Cl

InChI

InChI=1S/C8H12ClNO2/c1-6(11)10-4-2-7(3-5-10)8(9)12/h7H,2-5H2,1H3

InChIKey

OHCPVLJEAHBMEG-UHFFFAOYSA-N

LogP

1.0103

Topological Polar Surface Area

37.38 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

197

Safety Information

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Hazard Class

Class 8 Class 8

Sensitiveness

Moisture Sensitive

Synonyms & References

English

Acetylisonipecotoyl chloride
N-acetylisonipecotic acid chloride
1-ethanoylpiperidine-4-carbonyl chloride
SY101208
1-acetylpiperidine-4-carbonyl chloride, AldrichCPR
EN300-201272
NS00034077
N-Acetyl isonipecotoyl chloride
1-acetylisonipecotic acid chloride
1-acetyl piperidine-4-carbonyl chloride
1-Acetylpiperidine-4-carbonylchloride
Y14765
N-acetyl-isonipecotic acid chloride
95037-48-2
1-acetyl-4-piperidinyl carboxylic acid chloride
1-Acetylisonipecotoyl chloride
1-acetyl-piperidine-4-carboxylic acid chloride
FT-0607293
F0001-1546
4-Carboxychloro-N-acetoxypiperidine
1-Acetylpiperidine-4-carbonyl chloride
AKOS005254699
N-acetylisonipecotyl chloride
1-ACETYLPIPERIDINE-4-CARBONYL CHLORIDE HYDROCHLORIDE
MFCD02094017
1-Acetyl-4-piperidylcarbonyl chloride
1-Acetyl-piperidine-4-carbonyl chloride
1-Acetylpiperidin-4-ylcarbonyl chloride
59084-16-1
SCHEMBL229158
CS-10851

MDL Number

MFCD02094017

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 1-Acetyl-4-piperidinecarbonyl chloride (CAS: 59084-16-1)?

1-Acetyl-4-piperidinecarbonyl chloride is a white crystalline solid with a molecular weight of approximately 230.24 g/mol. It is poorly soluble in water but soluble in organic solvents. It is a reactive compound, particularly in nucleophilic substitution reactions. It is often stored in a refrigerator to maintain its crystalline form.

How is 1-Acetyl-4-piperidinecarbonyl chloride (CAS: 59084-16-1) typically synthesized?

1-Acetyl-4-piperidinecarbonyl chloride is typically synthesized by the reaction of 4-piperidinecarboxylic acid with acetyl chloride in the presence of a suitable catalyst, such as an acid like sulfuric acid. The yield is generally around 80-90%, and the reaction is conducted under mild conditions to ensure good selectivity.

What industries use 1-Acetyl-4-piperidinecarbonyl chloride (CAS: 59084-16-1)?

1-Acetyl-4-piperidinecarbonyl chloride is used in the pharmaceutical industry for the synthesis of various drug candidates. It also finds applications in the polymer industry as a monomer for certain types of polymers, and in the sensor industry as a functional material in gas sensors due to its reactivity.

What precautions should be taken when handling 1-Acetyl-4-piperidinecarbonyl chloride (CAS: 59084-16-1)?

Precautions when handling 1-Acetyl-4-piperidinecarbonyl chloride include wearing appropriate personal protective equipment (PPE), such as gloves and safety goggles. It should be handled in a fume hood due to its reactivity. In case of a spill, neutralize the acid with a base and dispose of it according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed safety information.