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Home Other Building Blocks 80840-09-1
80840-09-1,MFCD01096782
Catalog No.:AA008LM2

80840-09-1 | 1-(Quinoxalin-2-yl)butane-1,2,3,4-tetraol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
in stock  
$234.00   $164.00
- +
250mg
95%
in stock  
$1,006.00   $704.00
- +
1g
95%
in stock  
$3,466.00   $2,427.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA008LM2
Chemical Name:
1-(Quinoxalin-2-yl)butane-1,2,3,4-tetraol
CAS Number:
80840-09-1
Molecular Formula:
C12H14N2O4
Molecular Weight:
250.2506
MDL Number:
MFCD01096782
SMILES:
OCC(C(C(c1cnc2c(n1)cccc2)O)O)O
NSC Number:
90835
Properties
Computed Properties
 
Complexity:
267  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
4  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
3  
XLogP3:
-1.5  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2010,vol.20,p.6773-6776

[2]BioorganicandMedicinalChemistryLetters,2013,vol.23,p.3221-3224

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Henry N, et al. Synthesis of water-compatible imprinted polymers of in situ produced fructosazine and 2,5-deoxyfructosazine. Talanta. 2012 Sep 15;99:816-23.

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SDS
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Tags:80840-09-1 Molecular Formula|80840-09-1 MDL|80840-09-1 SMILES|80840-09-1 1-(Quinoxalin-2-yl)butane-1,2,3,4-tetraol