(1-Acetyl-4-piperidinyl)acetic acid

Basic Information

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CAS Number

78056-60-7

Molecular Formula

C9H15NO3

Molecular Weight

185.22 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

Boiling Point

389.6℃ at 760 mmHg

Density

1.150

SMILES

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CC(=O)N1CCC(CC1)CC(=O)O

InChI

InChI=1S/C9H15NO3/c1-7(11)10-4-2-8(3-5-10)6-9(12)13/h8H,2-6H2,1H3,(H,12,13)

InChIKey

SPNAWRHVQZEFHH-UHFFFAOYSA-N

LogP

0.7195999999999998

Topological Polar Surface Area

57.61 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

207

Synonyms & References

English

CCG-211481
n-acetylpiperidine-4-acetic acid
FT-0687359
MFCD12027293
SPNAWRHVQZEFHH-UHFFFAOYSA-N
1-Acetyl-4-piperidineacetic acid
DTXSID10439928
78056-60-7
EN300-317215
(1-acetylpiperidin-4-yl)acetic acid
4-Piperidineacetic acid, 1-acetyl-
1-Acetyl-4-piperidineaceticacid
1-N-ACETYL-4-PIPERIDINYLACETIC ACID
A13280
SY020456
DS-13998
AKOS000265843
(1-acetyl-4-piperidinyl)acetic acid
2-(1-acetylpiperidin-4-yl)acetic acid
(S)-1-(((9H-fluoren-9-yl)methoxy)carbonyl)piperidine-3-carboxylic acid;1-Acetyl-4-piperidineacetic Acid
Q-103051
SB41435
SCHEMBL2422675
(N-acetylpiperidin-4-yl)acetic acid
1-N-Acetyl-4-Piperidinylacetic Acid
ALBB-006957
ANW-48785
BBL008688
CTK7J2448
N-acetylpiperidine-4-acetic acid
SBB048480

MDL Number

MFCD12027293

FAQ

What are the physical and chemical properties of (1-Acetyl-4-piperidinyl)acetic acid (CAS: 78056-60-7)?

(1-Acetyl-4-piperidinyl)acetic acid is a crystalline solid with a molecular weight of approximately 212.29 g/mol. It has a pKa of about 4.0 and is slightly soluble in water. This compound is known for its reactivity, particularly in esterification and amide formation reactions.

How is (1-Acetyl-4-piperidinyl)acetic acid (CAS: 78056-60-7) typically synthesized?

(1-Acetyl-4-piperidinyl)acetic acid is commonly synthesized via a multi-step process starting from piperidine. The key steps involve acetylation of piperidine followed by acetylation of the resulting acetyl-piperidine derivative. This method provides good yield and selectivity under mild conditions.

What industries use (1-Acetyl-4-piperidinyl)acetic acid (CAS: 78056-60-7)?

(1-Acetyl-4-piperidinyl)acetic acid finds application in the pharmaceutical industry for drug synthesis, particularly as a precursor in the development of certain antipsychotic drugs. It is also used in the polymer industry for functionalizing polymers and in sensor technology for detecting specific analytes.

What precautions should be taken when handling (1-Acetyl-4-piperidinyl)acetic acid (CAS: 78056-60-7)?

When handling (1-Acetyl-4-piperidinyl)acetic acid, it is essential to wear appropriate personal protective equipment (PPE), including gloves and goggles. Ensure that all operations are conducted in a well-ventilated area or a fume hood. Spills should be cleaned up immediately using appropriate absorbents, and the material safety data sheet (MSDS) should be consulted for detailed emergency procedures.