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Substance Name: 1-Chloroheptane
RN: 629-06-1
UNII: 2F3Z1E37X5
InChIKey: DZMDPHNGKBEVRE-UHFFFAOYSA-N

Molecular Formula

  • C7-H15-Cl

Molecular Weight

  • 134.648
 
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Names and Synonyms

Name of Substance

  • 1-Chloroheptane

Synonyms

  • EINECS 211-070-9
  • UNII-2F3Z1E37X5

Systematic Names

  • 1-Chloroheptane
  • Heptane, 1-chloro-

Superlist Names

  • 1-Chloroheptane
  • normal-Heptyl chloride

Registry Numbers

CAS Registry Number

  • 629-06-1

FDA UNII

  • 2F3Z1E37X5

System Generated Number

  • 0000629061

Structure Descriptors

InChI

1S/C7H15Cl/c1-2-3-4-5-6-7-8/h2-7H2,1H3

InChIKey

DZMDPHNGKBEVRE-UHFFFAOYSA-N

Smiles

C(CCCCl)CCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -6.95E+01 deg C   EXP
Boiling Point 159 deg C   EXP
log P (octanol-water) 4.15 (none)   EXP
Water Solubility 13.6 mg/L 25 EXP
Henry's Law Constant 0.045 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 6.41E-12 cm3/molecule-sec 25 EST

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