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Substance Name: Benzene, (iodomethyl)-
RN: 620-05-3
InChIKey: XJTQJERLRPWUGL-UHFFFAOYSA-N

Molecular Formula

  • C7-H7-I

Molecular Weight

  • 218.032
 
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Names and Synonyms

Synonym

  • EINECS 210-623-1

Systematic Names

  • alpha-Iodotoluene
  • Benzene, (iodomethyl)-

Superlist Names

  • Benzyl iodide
  • Benzyl iodide [UN2653] [Poison]
  • UN2653

Registry Numbers

CAS Registry Number

  • 620-05-3

System Generated Number

  • 0000620053

Structure Descriptors

InChI

1S/C7H7I/c8-6-7-4-2-1-3-5-7/h1-5H,6H2

InChIKey

XJTQJERLRPWUGL-UHFFFAOYSA-N

Smiles

c1(ccccc1)CI

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 24.5 deg C   EXP
log P (octanol-water) 3.300 (none)   EST
Water Solubility 53.7 mg/L 25 EST
Henry's Law Constant 4.44E-04 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.51E-12 cm3/molecule-sec 25 EST

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