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126230-73-7,MFCD00835120
Catalog No.:AA000SAT

126230-73-7 | 2-tert-Butylpyrimidine-5-carboxylic acid

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000SAT
Chemical Name:
2-tert-Butylpyrimidine-5-carboxylic acid
CAS Number:
126230-73-7
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
MDL Number:
MFCD00835120
SMILES:
OC(=O)c1cnc(nc1)C(C)(C)C
Properties
Computed Properties
 
Complexity:
190  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.4  

Downstream Synthesis Route

[1]Frissen,A.E.;Marcelis,A.T.M.;Buurman,D.G;Pollmann,C.A.M.;Plas,H.C.vander[Tetrahedron,1989,vol.45,#17,p.5611-5620]

[1]Frissen,A.E.;Marcelis,A.T.M.;Buurman,D.G;Pollmann,C.A.M.;Plas,H.C.vander[Tetrahedron,1989,vol.45,#17,p.5611-5620]

[1]Frissen,A.E.;Marcelis,A.T.M.;Buurman,D.G;Pollmann,C.A.M.;Plas,H.C.vander[Tetrahedron,1989,vol.45,#17,p.5611-5620]

[1]Frissen,A.E.;Marcelis,A.T.M.;Buurman,D.G;Pollmann,C.A.M.;Plas,H.C.vander[Tetrahedron,1989,vol.45,#17,p.5611-5620]

[1]Frissen,A.E.;Marcelis,A.T.M.;Buurman,D.G;Pollmann,C.A.M.;Plas,H.C.vander[Tetrahedron,1989,vol.45,#17,p.5611-5620]

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

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Tags:126230-73-7 Molecular Formula|126230-73-7 MDL|126230-73-7 SMILES|126230-73-7 2-tert-Butylpyrimidine-5-carboxylic acid