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Substance Name: Piperidine, 5-ethyl-2-methyl-
RN: 104-89-2
InChIKey: XOFNHZHCGBPVGJ-UHFFFAOYSA-N

Molecular Formula

  • C8-H17-N

Molecular Weight

  • 127.229
 
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Names and Synonyms

Synonyms

  • 2-Methyl-5-ethylpiperidine
  • 2-Pipecoline, 5-ethyl-
  • 3-Ethyl-6-methylpiperidine
  • 4-20-00-01622 (Beilstein Handbook Reference)
  • 5-Ethyl-2-methylpiperidine
  • BRN 0079909
  • Copellidin
  • EINECS 203-249-5
  • NSC 6119

Systematic Names

  • 5-Ethyl-2-methylpiperidine
  • Copellidine (8CI)
  • Piperidine, 5-ethyl-2-methyl-

Superlist Names

  • 2-Methyl-5-ethylpiperidine
  • Piperidine, 5-ethyl-2-methyl-

Registry Numbers

CAS Registry Number

  • 104-89-2

Other Registry Number

  • 28821-82-1

System Generated Number

  • 0000104892

Structure Descriptors

InChI

1S/C8H17N/c1-3-8-5-4-7(2)9-6-8/h7-9H,3-6H2,1-2H3

InChIKey

XOFNHZHCGBPVGJ-UHFFFAOYSA-N

Smiles

C1[C@@H](CN[C@@H](C1)C)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin 630uL/kg (0.63mL/kg)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.
rabbit LDLo subcutaneous 100mg/kg (100mg/kg)   Berichte der Deutschen Chemischen Gesellschaft. Vol. 34, Pg. 2408, 1901.
rat LCLo inhalation 250ppm/4H (250ppm)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.
rat LD50 oral 540mg/kg (540mg/kg)   AMA Archives of Industrial Hygiene and Occupational Medicine. Vol. 10, Pg. 61, 1954.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.510 (none)   EST
Water Solubility 6840 mg/L 25 EST
Vapor Pressure 2.87 mm Hg 25 EXP
Henry's Law Constant 4.01E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.04E-10 cm3/molecule-sec 25 EST

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