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Home Boronic Acids 1396007-85-4
1396007-85-4,MFCD18383383
Catalog No.:AA00A0MJ

1396007-85-4 | Methyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarboxylate

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100mg
>98%
in stock  
$382.00   $268.00
- +
250mg
>98%
in stock  
$400.00   $280.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00A0MJ
Chemical Name:
Methyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarboxylate
CAS Number:
1396007-85-4
Molecular Formula:
C17H23BO4
Molecular Weight:
302.1731
MDL Number:
MFCD18383383
SMILES:
COC(=O)C1(CC1)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Computed Properties
 
Complexity:
432  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
4  

Downstream Synthesis Route
3-(4-bromo-phenyl)-5-methyl-3H-1,2,3triazol-4-yl-carbamicacid(R)-1-(2-fluoro-phenyl)-ethylester 
  1396007-85-4   
1-(4'-{5-(R)-1-(2-fluoro-phenyl)-ethoxycarbonylamino-4-methyl-1,2,3triazol-1-yl}-biphenyl-4-yl)-cyclopropanecarboxylicacidmethylester 

[1]Patent:WO2013/189865,2013,A1.Locationinpatent:Page/Pagecolumn36

[2]JournalofMedicinalChemistry,2012,vol.55,p.7920-7939,20

3-(4-bromo-phenyl)-5-methyl-3H-1,2,3triazol-4-yl-carbamicacid(R)-1-(2-trifluoromethyl-phenyl)-ethylester 
  1396007-85-4   
1-(4'-{5-(R)-1-(2-trifluoromethyl-phenyl)-ethoxycarbonylamino-4-methyl-1,2,3triazol-1-yl}-biphenyl-4-yl)-cyclopropanecarboxylicacidmethylester 

[1]Patent:WO2013/189865,2013,A1.Locationinpatent:Page/Pagecolumn38

[2]JournalofMedicinalChemistry,2012,vol.55,p.7920-7939,20

3-(4-bromo-phenyl)-5-methyl-3H-1,2,3triazol-4-yl-carbamicacid(R)-1-(3-trifluoromethyl-phenyl)-ethylester 
  1396007-85-4   
1-(4'-{4-methyl-5-(R)-1-(3-trifluoromethyl-phenyl)-ethoxycarbonylamino-1,2,3triazol-1-yl}-biphenyl-4-yl)-cyclopropanecarboxylicacidmethylester 

[1]Patent:WO2013/189865,2013,A1.Locationinpatent:Page/Pagecolumn40

[2]JournalofMedicinalChemistry,2012,vol.55,p.7920-7939,20

3-(4-bromo-phenyl)-5-methyl-3H-1,2,3triazol-4-yl-carbamicacid(R)-1-2-dimethyl-propylester 
  1396007-85-4   
1-{4'-5-((R)-1,2-dimethyl-propoxycarbonylamino)-4-methyl-1,2,3triazol-1-yl-biphenyl-4-yl}-cyclopropanecarboxylicacidmethylester 

[1]Patent:WO2013/189865,2013,A1.Locationinpatent:Page/Pagecolumn43-44

[2]JournalofMedicinalChemistry,2012,vol.55,p.7920-7939,20

3-(4-bromo-phenyl)-5-methyl-3H-1,2,3triazol-4-yl-carbamicacid(R)-sec-butylester 
  1396007-85-4   
1-{4'-5-((R)-sec-butoxycarbonylamino)-4-methyl-1,2,3triazol-1-yl-biphenyl-4-yl}-cyclopropanecarboxylicacidmethylester 

[1]Patent:WO2013/189865,2013,A1.Locationinpatent:Page/Pagecolumn45-46

[2]JournalofMedicinalChemistry,2012,vol.55,p.7920-7939,20

Literature
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Tags:1396007-85-4 Molecular Formula|1396007-85-4 MDL|1396007-85-4 SMILES|1396007-85-4 Methyl 1-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)cyclopropanecarboxylate