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624-95-3,MFCD10700131
Catalog No.:AA003B7W

624-95-3 | 3,3-Dimethylbutan-1-ol

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Purity
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1g
95%
in stock  
$8.00   $6.00
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5g
95%
in stock  
$10.00   $7.00
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10g
95%
in stock  
$19.00   $13.00
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25g
95%
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$29.00   $20.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003B7W
Chemical Name:
3,3-Dimethylbutan-1-ol
CAS Number:
624-95-3
Molecular Formula:
C6H14O
Molecular Weight:
102.1748
MDL Number:
MFCD10700131
SMILES:
OCCC(C)(C)C
NSC Number:
54158
Properties
Properties
 
BP:
143°C at 760 mmHg  
Form:
Solid  
MP:
60 °C(lit.)  
Refractive Index:
n20/D 1.414(lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
42.6  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.6  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistry,2000,vol.8,#3,p.665-674

[2]JournaloftheAmericanChemicalSociety,1992,vol.114,#5,p.1778-1784

[3]Patent:US8299287,2012,B2,.Locationinpatent:Page/Pagecolumn53

[4]Patent:JP6196581,2017,B2,.Locationinpatent:Paragraph0186

[5]ChemischeBerichte,1983,vol.116,#4,p.1345-1363

[6]ChemicalandPharmaceuticalBulletin,1992,vol.40,#9,p.2391-2398

[7]Patent:US2022485,1933,,

[8]RecueildesTravauxChimiquesdesPays-Bas,1936,vol.55,p.903,914

[9]Chem.Zentralbl.,1906,vol.77,#I,p.1233

[10]GazzettaChimicaItaliana,1974,vol.104,p.273-286

[11]NatureChemistry,2010,vol.2,#4,p.280-285

[12]Patent:US2010/267907,2010,A1,

Literature

Title: Sulfur mustard induced mast cell degranulation in mouse skin is inhibited by a novel anti-inflammatory and anticholinergic bifunctional prodrug.

Journal: Toxicology letters 20180901

Title: Incorporation of ionic ligands accelerates drug release from LDI-glycerol polyurethanes.

Journal: Acta biomaterialia 20100101

Title: Magnetic quantum tunneling: key insights from multi-dimensional high-field EPR.

Journal: Physical chemistry chemical physics : PCCP 20090821

Title: Recovery of choline oxidase activity by in vitro recombination of individual segments.

Journal: Applied microbiology and biotechnology 20081101

Title: On the contribution of the positively charged headgroup of choline to substrate binding and catalysis in the reaction catalyzed by choline oxidase.

Journal: Archives of biochemistry and biophysics 20060715

Title: Single-molecule magnets: high-field electron paramagnetic resonance evaluation of the single-ion zero-field interaction in a Zn(II)3Ni(II) complex.

Journal: Inorganic chemistry 20050530

Title: The trimethylammonium headgroup of choline is a major determinant for substrate binding and specificity in choline oxidase.

Journal: Archives of biochemistry and biophysics 20041015

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SDS
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