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Substance Name: n-Nonacosane
RN: 630-03-5
UNII: IGL1697BK1
InChIKey: IGGUPRCHHJZPBS-UHFFFAOYSA-N

Note

  • Constituent of Apocynum venetum leaf.

Molecular Formula

  • C29-H60

Molecular Weight

  • 408.793
 
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Names and Synonyms

Name of Substance

  • n-Nonacosane
  • Nonacosane

Synonyms

  • AI3-36284
  • EINECS 211-126-2
  • HSDB 8359
  • UNII-IGL1697BK1

Systematic Name

  • Nonacosane

Registry Numbers

CAS Registry Number

  • 630-03-5

FDA UNII

  • IGL1697BK1

System Generated Number

  • 0000630035

Structure Descriptors

InChI

InChI=1S/C29H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-29H2,1-2H3

InChIKey

IGGUPRCHHJZPBS-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 63.7 deg C   EXP
Boiling Point 440.8 deg C   EXP
log P (octanol-water) 14.58 (none)   EST
Water Solubility 2.76E-10 mg/L 25 EST
Henry's Law Constant 1150 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.80E-11 cm3/molecule-sec 25 EST

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