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Substance Name: Pentatriacontane
RN: 630-07-9
UNII: KP13LFH341
InChIKey: VHQQPFLOGSTQPC-UHFFFAOYSA-N

Molecular Formula

  • C35-H72

Molecular Weight

  • 492.954
 
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Names and Synonyms

Name of Substance

  • Pentatriacontane

Synonyms

  • n-Pentatriacontane
  • NSC 125400
  • UNII-KP13LFH341

Systematic Name

  • Pentatriacontane (8CI)(9CI)

Registry Numbers

CAS Registry Number

  • 630-07-9

FDA UNII

  • KP13LFH341

System Generated Number

  • 0000630079

Structure Descriptors

InChI

InChI=1S/C35H72/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-35H2,1-2H3

InChIKey

VHQQPFLOGSTQPC-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 75 deg C   EXP
Boiling Point 490 deg C   EXP
log P (octanol-water) 17.53 (none)   EST
Water Solubility 2.47E-13 mg/L 25 EST
Henry's Law Constant 6320 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.64E-11 cm3/molecule-sec 25 EST

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