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Substance Name: Squalane [NF]
RN: 111-01-3
UNII: GW89575KF9
InChIKey: PRAKJMSDJKAYCZ-UHFFFAOYSA-N

Classification Codes

  • Pharmaceutic Aid (Vehicle, Oleaginous)
  • Skin / Eye Irritant

Molecular Formula

  • C30-H62

Molecular Weight

  • 422.82
 
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Names and Synonyms

Name of Substance

  • Squalane
  • Squalane [NF]

Synonyms

  • 2,6,10,15,19,23-Hexamethyltetracosane
  • 4-01-00-00593 (Beilstein Handbook Reference)
  • AI3-36494
  • BRN 0776019
  • Caswell No. 482A
  • CCRIS 9473
  • Cosbiol
  • Dodecahydrosqualene
  • EC 203-825-6
  • EINECS 203-825-6
  • EPA Pesticide Chemical Code 045503
  • Hexamethyl tetracosane
  • Hexamethyltetracosane
  • NSC 6851
  • Perhydrosqualene
  • Robane
  • Spinacane
  • Squalane
  • UNII-GW89575KF9
  • Vitabiosol

Systematic Names

  • 2,6,10,15,19,23-Hexamethyltetracosane
  • Tetracosane, 2,6,10,15,19,23-hexamethyl-

Registry Numbers

CAS Registry Number

  • 111-01-3

FDA UNII

  • GW89575KF9

Other Registry Number

  • 2101721-37-1

System Generated Number

  • 0000111013

Structure Descriptors

InChI

1S/C30H62/c1-25(2)15-11-19-29(7)23-13-21-27(5)17-9-10-18-28(6)22-14-24-30(8)20-12-16-26(3)4/h25-30H,9-24H2,1-8H3

InChIKey

PRAKJMSDJKAYCZ-UHFFFAOYSA-N

Smiles

C([C@@H](CCCC(C)C)C)CC[C@@H](CCCC[C@@H](CCC[C@@H](CCCC(C)C)C)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.80E+01 deg C   EXP
Boiling Point 350 deg C   EXP
log P (octanol-water) 14.63 (none)   EST
Atmospheric OH Rate Constant 4.05E-11 cm3/molecule-sec 25 EST

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