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Substance Name: 2-Chlorooctane
RN: 628-61-5
UNII: 0H8W4Y2ETW
InChIKey: HKDCIIMOALDWHF-UHFFFAOYSA-N

Molecular Formula

  • C8-H17-Cl

Molecular Weight

  • 148.675
 
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Names and Synonyms

Name of Substance

  • 2-Chlorooctane

Synonyms

  • 1-Methylheptyl chloride
  • 2-Chlorooctane
  • 2-Octyl chloride
  • EINECS 211-046-8
  • NSC 5407
  • UNII-0H8W4Y2ETW

Systematic Names

  • 2-Chlorooctane
  • Octane, 2-chloro-

Registry Numbers

CAS Registry Number

  • 628-61-5

FDA UNII

  • 0H8W4Y2ETW

Other Registry Number

  • 51261-14-4

System Generated Number

  • 0000628615

Structure Descriptors

InChI

1S/C8H17Cl/c1-3-4-5-6-7-8(2)9/h8H,3-7H2,1-2H3

InChIKey

HKDCIIMOALDWHF-UHFFFAOYSA-N

Smiles

C(C[C@@H](C)Cl)CCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 172 deg C   EXP
log P (octanol-water) 4.450 (none)   EST
Water Solubility 12.2 mg/L 25 EST
Vapor Pressure 1.37 mm Hg 25 EXP
Henry's Law Constant 0.060 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.92E-12 cm3/molecule-sec 25 EST

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