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Home Bromides 1380089-33-7
1380089-33-7,MFCD24387374
Catalog No.:AA0017QO

1380089-33-7 | (4-Bromo-3-methylisoxazol-5-yl)methyl acetate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
97%
in stock  
$47.00   $33.00
- +
1g
97%
in stock  
$125.00   $88.00
- +
  • 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:
AA0017QO
Chemical Name:
(4-Bromo-3-methylisoxazol-5-yl)methyl acetate
CAS Number:
1380089-33-7
Molecular Formula:
C7H8BrNO3
Molecular Weight:
234.0473
MDL Number:
MFCD24387374
SMILES:
CC(=O)OCc1onc(c1Br)C
Properties
Computed Properties
 
Complexity:
176  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
3  
XLogP3:
1.2  

Upstream Synthesis Route

[1]Patent:WO2012/75383,2012,A2,.Locationinpatent:Page/Pagecolumn82

[2]ACSMedicinalChemistryLetters,2013,vol.4,#9,p.835-840

[3]Patent:WO2013/184878,2013,A1,.Locationinpatent:Paragraph00241;00242

[4]Patent:WO2013/184876,2013,A1,.Locationinpatent:Paragraph00144;00147;00148

[5]Patent:WO2016/97870,2016,A1,.Locationinpatent:Paragraph0168

[6]Patent:WO2017/30814,2017,A1,.Locationinpatent:Paragraph00229

[1]Patent:US2016/145248,2016,A1,.Locationinpatent:Paragraph0305;0306

[2]Patent:CN105473581,2016,A,.Locationinpatent:Paragraph0344;0345;0375;0387

[3]AngewandteChemie-InternationalEdition,2018,vol.57,#5,p.1346-1350

[4]Angew.Chem.,2018,vol.130,p.1360-1364,5

[1]Patent:WO2013/184876,2013,A1,

[1]Patent:WO2016/97870,2016,A1,

[1]Patent:WO2016/97870,2016,A1,

Downstream Synthesis Route

[1]Patent:WO2012/75383,2012,A2.Locationinpatent:Page/Pagecolumn82-83

[2]ACSMedicinalChemistryLetters,2013,vol.4,p.835-840

[3]Patent:WO2013/184876,2013,A1.Locationinpatent:Paragraph00144;00149;00150

[4]ChemMedChem,2017,vol.12,p.50-65

[5]Patent:WO2017/1733,2017,A1.Locationinpatent:Page/Pagecolumn35

[6]Patent:WO2013/184878,2013,A1.Locationinpatent:Paragraph00244;00245

[1]Patent:WO2012/75383,2012,A2.Locationinpatent:Page/Pagecolumn82

[2]ACSMedicinalChemistryLetters,2013,vol.4,p.835-840

[3]Patent:WO2013/184878,2013,A1.Locationinpatent:Paragraph00241;00242

[4]Patent:WO2013/184876,2013,A1.Locationinpatent:Paragraph00144;00147;00148

[5]Patent:WO2016/97870,2016,A1.Locationinpatent:Paragraph0168

[6]Patent:WO2017/30814,2017,A1.Locationinpatent:Paragraph00229

[1]Patent:WO2012/75383,2012,A2

1380089-33-7   
C18H14ClNO3S 

[1]Patent:WO2012/75383,2012,A2

[1]Patent:WO2012/75383,2012,A2

Literature
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SDS
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Tags:1380089-33-7 Molecular Formula|1380089-33-7 MDL|1380089-33-7 SMILES|1380089-33-7 (4-Bromo-3-methylisoxazol-5-yl)methyl acetate