Home Other Building Blocks 111-01-3
111-01-3,MFCD00008953
Catalog No.:AA0035JE

111-01-3 | Squalane

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0035JE
Chemical Name:
Squalane
CAS Number:
111-01-3
Molecular Formula:
C30H62
Molecular Weight:
422.8133
MDL Number:
MFCD00008953
SMILES:
CC(CCCC(CCCC(C)C)C)CCCCC(CCCC(CCCC(C)C)C)C
NSC Number:
6851
Properties
Properties
 
BP:
470.3°C at 760 mmHg  
Form:
Liquid  
MP:
-38 °C(lit.);  
Refractive Index:
n20/D 1.452(lit.)  
Solubility:
chloroform: soluble100mg/mL, clear  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
308  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
30  
Rotatable Bond Count:
21  
Undefined Atom Stereocenter Count:
4  
XLogP3:
14.7  

Downstream Synthesis Route

[1]Soni,VineetKumar;Sharma,RakeshK.[ChemCatChem,2016,vol.8,#10,p.1763-1768]

[2]Gevorgyan,Ashot;Mkrtchyan,Satenik;Grigoryan,Tatevik;Iaroshenko,ViktorO.[ChemPlusChem,2018,vol.83,#5,p.375-382]

[3]Soerensenetal.[ActaChemicaScandinavica(1947),1951,vol.5,p.757,763]Sax;Stross[AnalyticalChemistry,1957,vol.29,p.1700]

[4]Soerensenetal.[ActaChemicaScandinavica(1947),1951,vol.5,p.757,763]Sax;Stross[AnalyticalChemistry,1957,vol.29,p.1700]

[5]Chapman[JournaloftheChemicalSociety,1923,vol.123,p.769]Heilbron;Hilditch;Kamm[JournaloftheChemicalSociety,1926,p.3125]

[6]Staudinger;Mojen[Kautschuk,1936,vol.12,p.122][ChemischesZentralblatt,1936,vol.107,#II,p.3648]

[7]Tsujimoto[ChemischesZentralblatt,1918,vol.89,#I,p.639]

[1]Mandai,Tadakatsu;Yamaguchi,Hirofumi;Nishikawa,Kengo;Kawada,Mikio;Otera,Junzo[TetrahedronLetters,1981,vol.22,p.763-764]

(6E,10E,14E,18E)-2,6,10,15,19,23-Hexamethyl-tetracosa-2,6,10,14,18,22-hexaene 
  111-01-3 

[1]Muzart,J.;Pete,J.P.[BulletindelaSocieteChimiquedeFrance,1984,vol.2,#1-2,p.56-58]

(6E,18E)-2,6,10,15,19,23-hexamethyl-2,6,18,22-tetracosatetraene-11,13-diyne-10,15-diol 
  111-01-3 

[1]Nishida;Ninagawa;Itoi;Fujita[BulletinoftheChemicalSocietyofJapan,1983,vol.56,#9,p.2805-2810]

[1]Cygler,Joanna;Teather,GeorgeG.;Klassen,NormanV.[JournalofPhysicalChemistry,1983,vol.87,#3,p.455-460]

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Tags:111-01-3 Molecular Formula|111-01-3 MDL|111-01-3 SMILES|111-01-3 Squalane |Organic_Building_Blocks