Pipecolic acid

Base Information

• Chemical Name: Pipecolic acid
• CAS No.: 535-75-1
• Deprecated CAS: 4043-87-2
• Molecular Formula: C₆H₁₁NO₂
• Molecular Weight: 129.159
• Hs Code.: 29339900
• European Community (EC) Number: 223-737-1,208-616-3
• NSC Number: 93089,17125
• UNII: H254GW7PVV
• DSSTox Substance ID: DTXSID40862144
• Nikkaji Number: J1.592J
• Wikipedia: Pipecolic_acid
• Wikidata: Q7197255
• Metabolomics Workbench ID: 130145
• ChEMBL ID: CHEMBL308408
• Mol file: 535-75-1.mol

Synonyms:2-piperidinecarboxylic acid;homopipecolic acid;L-pipecolic acid;pipecolic acid;pipecolic acid hydrochloride, (+-)-isomer;pipecolic acid, (+,-)-isomer;pipecolic acid, (-)-;pipecolic acid, (R)-isomer;pipecolic acid, (S)-isomer;pipecolic acid, 14C-labeled cpd, (+,-)-isomer;pipecolic acid, ion (1-);pipecolic acid, ion(1-), (+,-)-isomer;pipecolic acid, ion(1-), (S)-isomer;pipecolic acid, monopotassium salt

Chemical Property of Pipecolic acid

Chemical Property:

• Appearance/Colour: white to light beige fine crystalline powder
• Melting Point: 282 °C (dec.)(lit.)
• Refractive Index: 1.4587 (estimate)
• Boiling Point: 265.8 °C at 760 mmHg
• PKA: 2.28, 10.72(at 25℃)
• Flash Point: 114.5 °C
• PSA: 49.33000
• Density: 1.125 g/cm³
• LogP: 0.54190
• Storage Temp.: Sealed in dry,Room Temperature
• Water Solubility.: soluble
• XLogP3: -2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 129.078978594
• Heavy Atom Count: 9
• Complexity: 114

Purity/Quality:

98% Min ^*data from raw suppliers

DL-Pipecolic Acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCNC(C1)C(=O)O
• Uses: DL-Pipecolinic acid is used as a diagnostic marker of pyridoxine-dependent epilepsy. It acts as a ligand in copper-catalyzed approach for P-arylation of organophosphorus compounds. It is used as organocatalyst and novel substrate in organic synthesis.