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Substance Name: 2-Methylpiperidine
RN: 109-05-7
UNII: 22E509663B
InChIKey: NNWUEBIEOFQMSS-UHFFFAOYSA-N

Molecular Formula

  • C6-H13-N

Molecular Weight

  • 99.1757
 
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Names and Synonyms

Name of Substance

  • 2-Methylpiperidine

Synonyms

  • 2-Methylpiperidine
  • 5-20-04-00071 (Beilstein Handbook Reference)
  • alpha-Methylpiperidine
  • alpha-Pipecolin
  • alpha-Pipecoline
  • BRN 0079804
  • EINECS 203-642-1
  • NSC 31047
  • PIPECOLINE, ALPHA
  • Pipicoline
  • UNII-22E509663B

Systematic Names

  • 2-Methylpiperidine
  • 2-Pipecoline (8CI)
  • Piperidine, 2-methyl-

Registry Numbers

CAS Registry Number

  • 109-05-7

FDA UNII

  • 22E509663B

Other Registry Number

  • 3000-79-1

System Generated Number

  • 0000109057

Structure Descriptors

InChI

1S/C6H13N/c1-6-4-2-3-5-7-6/h6-7H,2-5H2,1H3

InChIKey

NNWUEBIEOFQMSS-UHFFFAOYSA-N

Smiles

C1[C@@H](NCCC1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LDLo subcutaneous 300mg/kg (300mg/kg)   Berichte der Deutschen Chemischen Gesellschaft. Vol. 34, Pg. 2408, 1901.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 120 deg C   EXP
pKa Dissociation Constant 11.08 (none) 25 EXP
log P (octanol-water) 1.610 (none)   EST
Water Solubility 5.09E+04 mg/L 25 EST
Vapor Pressure 19.3 mm Hg 25 EXP
Henry's Law Constant 2.28E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.00E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.