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Key Documents

696439

Sigma-Aldrich

(S)-Ethyl piperidine-3-carboxylate

97%

Synonym(s):

(S)-3-Piperidinecarboxylic acid ethyl ester, (S)-Ethyl nipecotate

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About This Item

Empirical Formula (Hill Notation):
C8H15NO2
CAS Number:
Molecular Weight:
157.21
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

form

liquid

refractive index

n20/D 1.471

density

1.043 g/mL at 25 °C

SMILES string

CCOC(=O)[C@H]1CCCNC1

InChI

1S/C8H15NO2/c1-2-11-8(10)7-4-3-5-9-6-7/h7,9H,2-6H2,1H3/t7-/m0/s1

InChI key

XIWBSOUNZWSFKU-ZETCQYMHSA-N

Application

Reactant for synthesis of:
  • DPP-4 inhibitors
  • JAK2 inhibitors
  • Serotonin and noradrenaline reuptake inhibitors
  • Human tryptase inhibitors
  • Anti-thrombotic nicecotamides

Reactive for oxidative C-arylation of free (NH)-heterocycles via direct (sp3) C-H bond functionalization

Pictograms

Corrosion

Signal Word

Danger

Hazard Statements

Precautionary Statements

Hazard Classifications

Eye Dam. 1

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

170.1 °F

Flash Point(C)

76.7 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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