Home Other Building Blocks 767-90-8
767-90-8,MFCD03093889
Catalog No.:AA003BKA

767-90-8 | 2-Ethylbenzyl alcohol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$23.00   $16.00
- +
1g
97%
in stock  
$47.00   $33.00
- +
5g
97%
in stock  
$119.00   $83.00
- +
10g
97%
in stock  
$216.00   $151.00
- +
25g
97%
in stock  
$428.00   $300.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003BKA
Chemical Name:
2-Ethylbenzyl alcohol
CAS Number:
767-90-8
Molecular Formula:
C9H12O
Molecular Weight:
136.1910
MDL Number:
MFCD03093889
SMILES:
OCc1ccccc1CC
Properties
Properties
 
BP:
229°C at 760 mmHg  
Form:
Liquid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
90.7  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Upstream Synthesis Route

[1]JustusLiebigsAnnalenderChemie,1918,vol.417,p.75

[2]JournaloftheAmericanChemicalSociety,1991,vol.113,#25,p.9630-9639

[3]Patent:EP3196191,2017,A1,.Locationinpatent:Paragraph0053;0054

[1]AdvancedSynthesisandCatalysis,2018,vol.360,#18,p.3544-3552

[1]Tetrahedron,1999,vol.55,#44,p.12907-12928

[2]JournalofMedicinalChemistry,1981,vol.24,#4,p.382-389

[1]JournalofMedicinalChemistry,2003,vol.46,#19,p.4104-4112

[1]JournaloftheAmericanChemicalSociety,1991,vol.113,#25,p.9630-9639

Downstream Synthesis Route

[1]ChemischeBerichte,1902,vol.35,p.901

[1]PhilosophicalTransactionsoftheRoyalSocietyofLondon,1948,vol.<A>241,p.147,188

[2]JournaloftheChemicalSociety.PerkintransactionsI,1974,p.2339-2342

[1]JournalfurpraktischeChemie(Leipzig1954),1910,vol.<2>82,p.539

[1]ChemischeBerichte,1898,vol.31,p.2640

[1]MonatsheftefurChemie,1914,vol.35,p.332    MonatsheftefuerChemie,1915,vol.36,p.6

Literature

Title: Using fragment cocktail crystallography to assist inhibitor design of Trypanosoma brucei nucleoside 2-deoxyribosyltransferase.

Journal: Journal of medicinal chemistry 20061005

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SDS
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