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Substance Name: Heptanol
RN: 53535-33-4
InChIKey: BBMCTIGTTCKYKF-UHFFFAOYSA-N

Molecular Formula

  • C7-H16-O

Molecular Weight

  • 116.2024
 
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Links to Resources

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Regulatory Agencies (Superlist Locators)

  • CAA2

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Names and Synonyms

Synonym

  • EINECS 258-615-7

Systematic Names

  • Heptan-1-ol
  • Heptanol

Superlist Name

  • Heptanol

Registry Numbers

CAS Registry Number

  • 53535-33-4

System Generated Number

  • 0053535334

Structure Descriptors

InChI

1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3

InChIKey

BBMCTIGTTCKYKF-UHFFFAOYSA-N

Smiles

CCCCCCCO

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.310 (none)   EST
Water Solubility 1800 mg/L   EXP
Henry's Law Constant 2.34E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.11E-11 cm3/molecule-sec 25 EST

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