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3302-10-1,MFCD00020507
Catalog No.:AA003IGT

3302-10-1 | 3,5,5-Trimethylhexanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100g
98%
in stock  
$8.00   $6.00
- +
500g
98%
in stock  
$24.00   $17.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003IGT
Chemical Name:
3,5,5-Trimethylhexanoic acid
CAS Number:
3302-10-1
Molecular Formula:
C9H18O2
Molecular Weight:
158.2380
MDL Number:
MFCD00020507
SMILES:
CC(CC(C)(C)C)CC(=O)O
NSC Number:
52185
Properties
Properties
 
BP:
121 °C (10 mmHg)  
Form:
Liquid  
MP:
-70°C  
Refractive Index:
1.4278-1.4298  
Solubility:
Miscible with the usual organic solvents.  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
133  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:OmanOilCompany(in:GovernmentofOman);GOVERNMENTOFOMAN-US2014/343310,2014,A1Locationinpatent:Paragraph0050

[2]CurrentPatentAssignee:OmanOilCompany(in:GovernmentofOman);GOVERNMENTOFOMAN-US2014/357881,2014,A1Locationinpatent:Paragraph0058-0059

[3]Adelman[JournalofOrganicChemistry,1949,vol.14,p.1059]

[1]JournaloftheChemicalSociety,1951,p.2543

[2]IndustrialandEngineeringChemistry,1949,vol.41,p.2861

[3]OrganicProcessResearchandDevelopment,2019,vol.23,p.1709-1717

[1]Bouilloux[BulletindelaSocieteChimiquedeFrance,1958,p.1446]

[1]CurrentPatentAssignee:GOVERNMENTOFOMAN;OmanOilCompany(in:GovernmentofOman)-EP1657230,2006,A1Locationinpatent:Page/Pagecolumn10-11

[2]CurrentPatentAssignee:GOVERNMENTOFOMAN;OmanOilCompany(in:GovernmentofOman)-EP1657230,2006,A1Locationinpatent:Page/Pagecolumn10;11

[3]CurrentPatentAssignee:GOVERNMENTOFOMAN;OmanOilCompany(in:GovernmentofOman)-EP1657230,2006,A1Locationinpatent:Page/Pagecolumn10;11

[4]CurrentPatentAssignee:GOVERNMENTOFOMAN;OmanOilCompany(in:GovernmentofOman)-EP1657230,2006,A1Locationinpatent:Page/Pagecolumn9-10;11

[5]Vanoye,Laurent;Pablos,Mertxe;Smith,Neil;DeBellefon,Claude;Favre-Rguillon,Alain[RSCAdvances,2014,vol.4,#100,p.57159-57163]

[6]CurrentPatentAssignee:OmanOilCompany(in:GovernmentofOman);GOVERNMENTOFOMAN-US2007/265467,2007,A1Locationinpatent:Page/Pagecolumn6-7;10

[7]Bruner[IndustrialandEngineeringChemistry,1949,vol.41,p.2861]CurrentPatentAssignee:DUPONTDENEMOURSINC-US2470859,1948,A

[8]Bruner[IndustrialandEngineeringChemistry,1949,vol.41,p.2861]CurrentPatentAssignee:DUPONTDENEMOURSINC-US2470859,1948,A

[9]Hock,H.;Kropf,H.[JournalfurpraktischeChemie(Leipzig1954),1961,vol.14,p.71-83]

[10]CurrentPatentAssignee:BASFSE-US2011/87038,2011,A1Locationinpatent:Page/Pagecolumn6

[11]CurrentPatentAssignee:BASFSE-US2011/137077,2011,A1Locationinpatent:Page/Pagecolumn9-10

[1]Bruner[IndustrialandEngineeringChemistry,1949,vol.41,p.2861]

Literature
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SDS
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