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Home Other Building Blocks 21188-58-9
21188-58-9,MFCD00083583
Catalog No.:AA003RPP

21188-58-9 | Methyl 3-hydroxyhexanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$46.00   $32.00
- +
5mg
≥98%
in stock  
$156.00   $109.00
- +
25mg
≥98%
in stock  
$219.00   $153.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003RPP
Chemical Name:
Methyl 3-hydroxyhexanoate
CAS Number:
21188-58-9
Molecular Formula:
C7H14O3
Molecular Weight:
146.1843
MDL Number:
MFCD00083583
SMILES:
CCCC(CC(=O)OC)O
FEMA Number:
3508
Properties
Properties
 
BP:
223°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
n20/D 1.43(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
101  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
Undefined Atom Stereocenter Count:
1  
XLogP3:
0.7  

Downstream Synthesis Route
3-hydroxyhexanoicacid 
  21188-58-9 

[1]Braun,Manfred;Devant,Ralf[TetrahedronLetters,1984,vol.25,#44,p.5031-5034]

[1]TetrahedronLetters,1992,vol.33,p.6193-6196

[1]Davis,AnthonyP.;Hegarty,StephenC.[JournaloftheAmericanChemicalSociety,1992,vol.114,#7,p.2745-2746]

3-Hydroperoxy-hexanoicacidmethylester 
  21188-58-9 

[1]Isayama,Shigeru[BulletinoftheChemicalSocietyofJapan,1990,vol.63,#5,p.1305-1310]

[1]Ketelaar,PeterE.F.;Staring,EmielG.J.;Wynberg,Hans[TetrahedronLetters,1985,vol.26,#38,p.4665-4668]

Literature

Title: Integrating heterogeneous odor response data into a common response model: A DoOR to the complete olfactome.

Journal: Chemical senses 20100901

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SDS
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