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832684-43-2,MFCD04969897
Catalog No.:AA0036F4

832684-43-2 | 5-tert-Butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
75%
in stock  
$522.00   $365.00
- +
1g
75%
in stock  
$1,231.00   $862.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0036F4
Chemical Name:
5-tert-Butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxylic acid
CAS Number:
832684-43-2
Molecular Formula:
C12H17NO3
Molecular Weight:
223.2683
MDL Number:
MFCD04969897
SMILES:
OC(=O)c1noc2c1CC(CC2)C(C)(C)C
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
285  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
1  
XLogP3:
2.9  

Downstream Synthesis Route

[1]JournalofMedicinalChemistry,2008,vol.51,p.1999-2002

Literature

Title: 5-tert-butyl-N-pyrazol-4-yl-4,5,6,7-tetrahydrobenzo[d]isoxazole-3-carboxamide derivatives as novel potent inhibitors of Mycobacterium tuberculosis pantothenate synthetase: initiating a quest for new antitubercular drugs.

Journal: Journal of medicinal chemistry 20080410

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
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Tags:832684-43-2 Molecular Formula|832684-43-2 MDL|832684-43-2 SMILES|832684-43-2 5-tert-Butyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxylic acid |Heterocyclic_Building_Blocks