Phenyl(2-piperidinyl)acetic acid

Basic Information

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CAS Number

19395-41-6

Molecular Formula

C13H17NO2

Molecular Weight

219.28 g/mol

EINECS

243-020-7

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

White to Light yellow

Melting Point

236-238°C

Boiling Point

367.7±17.0 °C(Predicted)

Density

1.138±0.06 g/cm3(Predicted)

Flash Point

176.2 ºC

Solubility

Methanol: 1 mg/ml

Refractive Index

1.499

SMILES

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C1CCNC(C1)C(C2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C13H17NO2/c15-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-3,6-7,11-12,14H,4-5,8-9H2,(H,15,16)

InChIKey

INGSNVSERUZOAK-UHFFFAOYSA-N

LogP

1.9969

pKa

3.50±0.10(Predicted)

Topological Polar Surface Area

49.33 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

236

Safety Information

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GHS Hazard Pictograms

H319

Hazard Statement

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

Phenyl(2-piperidinyl)acetic acid;2-Phenyl-2-piperidineacetic acid
FT-0653505
FT-0674442
2-Phenyl-2-(2-piperidyl) acetic acid
2-Piperidineacetic acid, alpha-phenyl-
SY030346
AC-8122
alpha-Phenyl-2-piperidine acetic acid (ritalinic acid)
Phenyl(2-piperidinyl)acetic acid
2-Phenyl-2-(piperidin-2-yl)acetic acid
L-threo-Ritalinic Acid;(2S)-2-Phenyl-2-[(S)-2-piperidinyl]acetic acid
BCP07811
Ritalinic Acid; Methylphenidate Related Compound A
FT-0674440
CS-W022954
DTXSID20864888
EINECS 243-020-7
NS00000318
FT-0674441
FT-0674438
CHEBI:83481
FS-3198
BCP26035
2-Phenyl-2-piperidineacetic acid
FT-0674435
alpha-Phenyl-2-piperidineacetic acid
AKOS015892837
DL-threo-Ritalinic AcidSee R533110
Phenyl(2-piperidinyl)acetic acid #
FT-0674439
2-phenyl-2-piperidin-2-ylacetic acid

MDL Number

MFCD06200695

EC Number

243-020-7

Customs Code

2933399090

FAQ

What is Phenyl(2-piperidinyl)acetic acid (CAS: 19395-41-6)?

Phenyl(2-piperidinyl)acetic acid is a chemical compound with the CAS number 19395-41-6. It is a white to off-white solid with a molecular formula of C12H17NO3. The compound exhibits moderate solubility in water and is commonly used in organic synthesis due to its structural versatility and reactivity.

What are the main uses of Phenyl(2-piperidinyl)acetic acid (CAS: 19395-41-6)?

Phenyl(2-piperidinyl)acetic acid is primarily used in pharmaceutical research as a building block for drug development. It also finds applications in the synthesis of various organic compounds, including those used in agrochemicals and materials science. Its utility stems from the presence of both acetic acid and piperidine functional groups.

Is Phenyl(2-piperidinyl)acetic acid (CAS: 19395-41-6) safe?

Phenyl(2-piperidinyl)acetic acid is generally considered safe when handled properly. However, it may cause mild irritation to the skin and eyes. It is recommended to use appropriate safety gear, such as gloves and goggles, and to work in a well-ventilated area. Safety data sheets (SDS) should be consulted for detailed handling and exposure guidelines.

How should Phenyl(2-piperidinyl)acetic acid (CAS: 19395-41-6) be stored?

Phenyl(2-piperidinyl)acetic acid should be stored in a cool, dry, and dark place, away from moisture and incompatible substances. It is best kept in a sealed container at a temperature below 25°C and in a humidity-controlled environment to maintain stability and prevent degradation.