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Substance Name: Nornicotine
RN: 494-97-3
UNII: 83H6L5QD8Z
InChIKey: MYKUKUCHPMASKF-VIFPVBQESA-N

Note

  • Agricultural or horticultural insecticide.

Molecular Formula

  • C9-H12-N2

Molecular Weight

  • 148.208
 

Classification Codes

  • Insecticides
  • Mutation Data
  • Pesticides
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Names and Synonyms

Name of Substance

  • Nornicotine

Synonyms

  • 1'-Demethyl nicotine
  • 2-(3-Pyridyl)pyrrolidine
  • 3-(2-Pyrrolidinyl)pyridine
  • 5-23-06-00062 (Beilstein Handbook Reference)
  • BRN 0081968
  • HSDB 8034
  • l-Nor-nicotine
  • Nornicotin
  • Nornicotine
  • Pyridine, 3-(2-pyrrolidinyl)-,(S)-
  • UNII-83H6L5QD8Z

Systematic Names

  • Nicotine, 1'-demethyl-, (S)-
  • Pyridine, 3-(2S)-2-pyrrolidinyl-

Registry Numbers

CAS Registry Number

  • 494-97-3

FDA UNII

  • 83H6L5QD8Z

System Generated Number

  • 0000494973

Structure Descriptors

InChI

1S/C9H12N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1,3,5,7,9,11H,2,4,6H2/t9-/m0/s1

InChIKey

MYKUKUCHPMASKF-VIFPVBQESA-N

Smiles

c1ncccc1[C@H]1NCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 14660ug/kg (14.66mg/kg)   Nara Igaku Zasshi. Journal of the Nara Medical Association. Vol. 8, Pg. 69, 1957.
mouse LD50 intravenous 3409ug/kg (3.409mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 88, Pg. 82, 1946.
rabbit LD50 intraperitoneal > 13700ug/kg (13.7mg/kg)   Proceedings of the Society for Experimental Biology and Medicine. Vol. 58, Pg. 231, 1945.
rabbit LD50 intravenous 3mg/kg (3mg/kg)   Proceedings of the Society for Experimental Biology and Medicine. Vol. 58, Pg. 231, 1945.
rat LDLo intraperitoneal 23500ug/kg (23.5mg/kg)   "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989Vol. 11, Pg. 1061, 1989.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 270 deg C   EXP
log P (octanol-water) 0.17 (none)   EXP
Water Solubility 1.00E+06 mg/L 25 EST
Vapor Pressure 9.70E-03 mm Hg 25 EST
Henry's Law Constant 1.37E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 8.67E-11 cm3/molecule-sec 25 EST

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