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954230-39-8,MFCD09756447
Catalog No.:AA006DBG

954230-39-8 | Ethyl 3-(4-fluorophenyl)-5-methylisoxazole-4-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
98%
in stock  
$75.00   $53.00
- +
250mg
98%
in stock  
$104.00   $73.00
- +
500mg
98%
in stock  
$129.00   $90.00
- +
2g
98%
in stock  
$275.00   $193.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006DBG
Chemical Name:
Ethyl 3-(4-fluorophenyl)-5-methylisoxazole-4-carboxylate
CAS Number:
954230-39-8
Molecular Formula:
C13H12FNO3
Molecular Weight:
249.2377
MDL Number:
MFCD09756447
SMILES:
CCOC(=O)c1c(C)onc1c1ccc(cc1)F
Properties
Properties
 
BP:
370.5°C at 760 mmHg  
Form:
Solid  
MP:
58-59℃  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
292  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.8  

Upstream Synthesis Route

[1]Patent:US2013/102778,2013,A1,.Locationinpatent:Paragraph0223;0224

[2]Patent:US2009/143385,2009,A1,

[3]Patent:WO2013/57124,2013,A1,.Locationinpatent:Page/Pagecolumn33

[4]Patent:US2013/172329,2013,A1,.Locationinpatent:Paragraph0245

[5]Patent:EP2792360,2014,A1,.Locationinpatent:Paragraph0168

[6]Patent:US2013/102778,2013,A1,

[7]Patent:WO2013/57123,2013,A1,.Locationinpatent:Page/Pagecolumn34

[8]Patent:WO2013/57123,2013,A1,

[9]Patent:US2013/172329,2013,A1,

[10]Patent:EP2792360,2014,A1,

[1]Patent:US2013/102778,2013,A1,.Locationinpatent:Paragraph0220

[2]Patent:WO2013/57123,2013,A1,.Locationinpatent:Page/Pagecolumn31

[3]Patent:US2013/172329,2013,A1,.Locationinpatent:Paragraph0257

[1]Patent:EP2792360,2014,A1,.Locationinpatent:Paragraph0175-0176

[1]Patent:US2013/172329,2013,A1,.Locationinpatent:Paragraph0244

[2]Patent:WO2013/57124,2013,A1,.Locationinpatent:Page/Pagecolumn33

[1]Patent:EP2792360,2014,A1,.Locationinpatent:Paragraph0168

Downstream Synthesis Route

[1]Patent:US2009/143385,2009,A1

[1]Patent:US2013/102778,2013,A1.Locationinpatent:Paragraph0223;0224

[2]Patent:US2009/143385,2009,A1

[3]Patent:WO2013/57124,2013,A1.Locationinpatent:Page/Pagecolumn33

[4]Patent:US2013/172329,2013,A1.Locationinpatent:Paragraph0245

[5]Patent:EP2792360,2014,A1.Locationinpatent:Paragraph0168

[6]Patent:US2013/102778,2013,A1

[7]Patent:WO2013/57123,2013,A1.Locationinpatent:Page/Pagecolumn34

[8]Patent:WO2013/57123,2013,A1

[9]Patent:US2013/172329,2013,A1

[10]Patent:EP2792360,2014,A1

[1]Patent:US2010/210651,2010,A1.Locationinpatent:Page/Pagecolumn28

[2]Patent:US2010/256127,2010,A1.Locationinpatent:Page/Pagecolumn16

[3]Patent:WO2010/127976,2010,A1.Locationinpatent:Page/Pagecolumn50

[4]Patent:WO2010/127975,2010,A1.Locationinpatent:Page/Pagecolumn112;113

[1]Patent:US2013/102778,2013,A1

[2]Patent:WO2013/57123,2013,A1

[3]Patent:WO2013/57124,2013,A1

[4]Patent:WO2013/57124,2013,A1

[5]Patent:US2013/172329,2013,A1

[6]Patent:US2013/172329,2013,A1

[7]Patent:EP2792360,2014,A1

[8]Patent:EP2792360,2014,A1

[9]InternationalJournalofPharmacyandPharmaceuticalSciences,2019,vol.11,p.1-7

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:954230-39-8 Molecular Formula|954230-39-8 MDL|954230-39-8 SMILES|954230-39-8 Ethyl 3-(4-fluorophenyl)-5-methylisoxazole-4-carboxylate
Catalog No.: AA006DBG
954230-39-8,MFCD09756447
954230-39-8 | Ethyl 3-(4-fluorophenyl)-5-methylisoxazole-4-carboxylate
Pack Size： 50mg
Purity： 98%
in stock
$75.00 $53.00
Pack Size： 250mg
Purity： 98%
in stock
$104.00 $73.00
Pack Size： 500mg
Purity： 98%
in stock
$129.00 $90.00
Pack Size： 2g
Purity： 98%
in stock
$275.00 $193.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006DBG
Chemical Name: Ethyl 3-(4-fluorophenyl)-5-methylisoxazole-4-carboxylate
CAS Number: 954230-39-8
Molecular Formula: C13H12FNO3
Molecular Weight: 249.2377
MDL Number: MFCD09756447
SMILES: CCOC(=O)c1c(C)onc1c1ccc(cc1)F
Properties
BP: 370.5°C at 760 mmHg  
Form: Solid  
MP: 58-59℃  
Storage: Keep in dry area;Room Temperature;  
Complexity: 292  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.8  
Upstream Synthesis Route
954230-39-8    1018297-63-6 

[1]Patent:US2013/102778,2013,A1,.Locationinpatent:Paragraph0223;0224

[2]Patent:US2009/143385,2009,A1,

[3]Patent:WO2013/57124,2013,A1,.Locationinpatent:Page/Pagecolumn33

[4]Patent:US2013/172329,2013,A1,.Locationinpatent:Paragraph0245

[5]Patent:EP2792360,2014,A1,.Locationinpatent:Paragraph0168

[6]Patent:US2013/102778,2013,A1,

[7]Patent:WO2013/57123,2013,A1,.Locationinpatent:Page/Pagecolumn34

[8]Patent:WO2013/57123,2013,A1,

[9]Patent:US2013/172329,2013,A1,

[10]Patent:EP2792360,2014,A1,

2723-42-4    459-23-4    954230-39-8 

[1]Patent:US2013/102778,2013,A1,.Locationinpatent:Paragraph0220

[2]Patent:WO2013/57123,2013,A1,.Locationinpatent:Page/Pagecolumn31

[3]Patent:US2013/172329,2013,A1,.Locationinpatent:Paragraph0257

54716-02-8    459-23-4    954230-39-8 

[1]Patent:EP2792360,2014,A1,.Locationinpatent:Paragraph0175-0176

4341-76-8    42202-95-9    954230-39-8 

[1]Patent:US2013/172329,2013,A1,.Locationinpatent:Paragraph0244

[2]Patent:WO2013/57124,2013,A1,.Locationinpatent:Page/Pagecolumn33

4341-76-8    393165-20-3    954230-39-8 

[1]Patent:EP2792360,2014,A1,.Locationinpatent:Paragraph0168

Downstream Synthesis Route
393165-20-3    954230-39-8 

[1]Patent:US2009/143385,2009,A1

954230-39-8    1018297-63-6 

[1]Patent:US2013/102778,2013,A1.Locationinpatent:Paragraph0223;0224

[2]Patent:US2009/143385,2009,A1

[3]Patent:WO2013/57124,2013,A1.Locationinpatent:Page/Pagecolumn33

[4]Patent:US2013/172329,2013,A1.Locationinpatent:Paragraph0245

[5]Patent:EP2792360,2014,A1.Locationinpatent:Paragraph0168

[6]Patent:US2013/102778,2013,A1

[7]Patent:WO2013/57123,2013,A1.Locationinpatent:Page/Pagecolumn34

[8]Patent:WO2013/57123,2013,A1

[9]Patent:US2013/172329,2013,A1

[10]Patent:EP2792360,2014,A1

954230-39-8    100-52-7    1240402-78-1 

[1]Patent:US2010/210651,2010,A1.Locationinpatent:Page/Pagecolumn28

[2]Patent:US2010/256127,2010,A1.Locationinpatent:Page/Pagecolumn16

[3]Patent:WO2010/127976,2010,A1.Locationinpatent:Page/Pagecolumn50

[4]Patent:WO2010/127975,2010,A1.Locationinpatent:Page/Pagecolumn112;113

459-57-4    954230-39-8 

[1]Patent:US2013/102778,2013,A1

[2]Patent:WO2013/57123,2013,A1

[3]Patent:WO2013/57124,2013,A1

[4]Patent:WO2013/57124,2013,A1

[5]Patent:US2013/172329,2013,A1

[6]Patent:US2013/172329,2013,A1

[7]Patent:EP2792360,2014,A1

[8]Patent:EP2792360,2014,A1

[9]InternationalJournalofPharmacyandPharmaceuticalSciences,2019,vol.11,p.1-7

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