813-72-9,MFCD00965097
Catalog No.:AA0052ZA

813-72-9 | 2,2-Dimethylhexanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
96%
in stock  
$87.00   $61.00
- +
1g
98%
in stock  
$105.00   $74.00
- +
5g
98%
in stock  
$364.00   $255.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0052ZA
Chemical Name:
2,2-Dimethylhexanoic acid
CAS Number:
813-72-9
Molecular Formula:
C8H16O2
Molecular Weight:
144.2114
MDL Number:
MFCD00965097
SMILES:
CCCCC(C(=O)O)(C)C
Properties
Properties
 
BP:
216-220°C  
Form:
Liquid  
MP:
-21.25°C (estimate)  
Refractive Index:
1.427  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
116  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Downstream Synthesis Route

[1]Elphimoff[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1947,vol.224,p.400]

592-76-7    201230-82-2    595-37-9   
2-methyl-2-ethylpentanoicacid 
  1185-39-3    813-72-9    75-98-9 

[1]Pirozhkov,S.D.;Stepanyan,A.S.;Myshenkova,T.N.;Ordyan,M.B.;Lapidus,A.L.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1982,vol.31,p.1852-1858][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1982,#9,p.2100-2106]

Literature

Title: Surface-catalysed reactions on pollutant-removing building products for indoor use.

Journal: Chemosphere 20090401

Quotation Request
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Additional Info:
SDS
Tags:813-72-9 Molecular Formula|813-72-9 MDL|813-72-9 SMILES|813-72-9 2,2-Dimethylhexanoic acid
Catalog No.: AA0052ZA
813-72-9,MFCD00965097
813-72-9 | 2,2-Dimethylhexanoic acid
Pack Size: 250mg
Purity: 96%
in stock
$87.00 $61.00
Pack Size: 1g
Purity: 98%
in stock
$105.00 $74.00
Pack Size: 5g
Purity: 98%
in stock
$364.00 $255.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0052ZA
Chemical Name: 2,2-Dimethylhexanoic acid
CAS Number: 813-72-9
Molecular Formula: C8H16O2
Molecular Weight: 144.2114
MDL Number: MFCD00965097
SMILES: CCCCC(C(=O)O)(C)C
Properties
BP: 216-220°C  
Form: Liquid  
MP: -21.25°C (estimate)  
Refractive Index: 1.427  
Storage: 2-8℃;  
Complexity: 116  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
Downstream Synthesis Route
996-12-3    813-72-9 

[1]Elphimoff[ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1947,vol.224,p.400]

592-76-7    201230-82-2    595-37-9   
2-methyl-2-ethylpentanoicacid 
  1185-39-3    813-72-9    75-98-9 

[1]Pirozhkov,S.D.;Stepanyan,A.S.;Myshenkova,T.N.;Ordyan,M.B.;Lapidus,A.L.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1982,vol.31,p.1852-1858][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1982,#9,p.2100-2106]

Literature fold

Title: Surface-catalysed reactions on pollutant-removing building products for indoor use.

Journal: Chemosphere20090401

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