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Substance Name: 1-Propanaminium, N,N,N-tripropyl-, iodide (1:1)
RN: 631-40-3
InChIKey: GKXDJYKZFZVASJ-UHFFFAOYSA-M

Molecular Formula

  • C12-H28-N.I

Molecular Weight

  • 313.26
 
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Names and Synonyms

Synonyms

  • EINECS 211-157-1
  • N,N,N-Tripropyl-1-propanaminium iodide
  • NSC 36747
  • Tetra-n-propylammonium iodide
  • Tetrapropylammonium iodide

Systematic Names

  • 1-Propanaminium, N,N,N-tripropyl-, iodide
  • 1-Propanaminium, N,N,N-tripropyl-, iodide (1:1)
  • Ammonium, tetrapropyl-, iodide
  • Tetrapropylammonium iodide

Registry Numbers

CAS Registry Number

  • 631-40-3

System Generated Number

  • 0000631403

Molecular Formulas

Molecular Formula

  • C12-H28-N.I

Molecular Formula Fragments

  • C12-H28-N
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C12H28N.HI/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H/q+1;/p-1

InChIKey

GKXDJYKZFZVASJ-UHFFFAOYSA-M

Smiles

[N+](CCC)(CCC)(CCC)CCC.[IH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 5600ug/kg (5.6mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00822,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 280 dec deg C   EXP
log P (octanol-water) -0.250 (none)   EST
Water Solubility 1.86E+05 mg/L 25 EXP
Vapor Pressure 8.10E-09 mm Hg 25 EST
Henry's Law Constant 2.54E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.80E-11 cm3/molecule-sec 25 EST

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