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Substance Name: Pentane, 1-iodo-
RN: 628-17-1
InChIKey: BLXSFCHWMBESKV-UHFFFAOYSA-N

Molecular Formula

  • C5-H11-I

Molecular Weight

  • 198.042
 
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Names and Synonyms

Synonyms

  • 1-Iodopentane
  • 1-Jodpentan
  • 1-Jodpentan [Czech]
  • 1-Pentyl iodide
  • Amyl iodide
  • EINECS 211-030-0
  • n-Amyl iodide
  • n-Pentyl iodide
  • NSC 7901
  • Pentyl iodide

Systematic Names

  • 1-Iodopentane
  • Pentane, 1-iodo-

Registry Numbers

CAS Registry Number

  • 628-17-1

System Generated Number

  • 0000628171

Structure Descriptors

InChI

1S/C5H11I/c1-2-3-4-5-6/h2-5H2,1H3

InChIKey

BLXSFCHWMBESKV-UHFFFAOYSA-N

Smiles

C(CCI)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 489mg/kg (489mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 21, 1982.
rat LD50 intraperitoneal 948mg/kg (948mg/kg)   "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982Vol. -, Pg. 21, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -8.56E+01 deg C   EXP
Boiling Point 155 deg C   EXP
log P (octanol-water) 3.560 (none)   EST
Water Solubility 41.2 mg/L 25 EST
Vapor Pressure 4.39 mm Hg 25 EXP
Henry's Law Constant 0.0194 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 3.87E-12 cm3/molecule-sec 25 EST

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