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Substance Name: 3-Pyridinepropanol
RN: 2859-67-8
InChIKey: ZUGAIMFLQLPTKB-UHFFFAOYSA-N

Molecular Formula

  • C8-H11-N-O

Molecular Weight

  • 137.181
 
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Names and Synonyms

Synonyms

  • 3-(3-Hydroxypropyl)pyridine
  • 3-(3-Pyridyl)-1-propanol
  • 3-(3-Pyridyl)propanol
  • 3-Propanolpyridine
  • 3-Pyridinepropanol
  • 5-21-02-00237 (Beilstein Handbook Reference)
  • BRN 0112609
  • EINECS 220-675-7
  • NSC 66564

Systematic Names

  • 3-(3-Pyridyl)propan-1-ol
  • 3-Pyridinepropanol

Registry Numbers

CAS Registry Number

  • 2859-67-8

System Generated Number

  • 0002859678

Structure Descriptors

InChI

1S/C8H11NO/c10-6-2-4-8-3-1-5-9-7-8/h1,3,5,7,10H,2,4,6H2

InChIKey

ZUGAIMFLQLPTKB-UHFFFAOYSA-N

Smiles

c1(cccnc1)CCCO

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01584,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 284 deg C   EXP
pKa Dissociation Constant 5.47 (none) 25 EXP
log P (octanol-water) 0.6 (none)   EXP
Water Solubility 1.00E+06 mg/L 25 EST
Vapor Pressure 1.73E-03 mm Hg 25 EST
Henry's Law Constant 5.01E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.64E-12 cm3/molecule-sec 25 EST

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