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1395493-30-7,MFCD22565660
Catalog No.:AA001B5U

1395493-30-7 | 2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$22.00   $16.00
- +
1g
95%
in stock  
$25.00   $18.00
- +
5g
95%
in stock  
$116.00   $81.00
- +
25g
95%
in stock  
$390.00   $273.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA001B5U
Chemical Name:
2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester
CAS Number:
1395493-30-7
Molecular Formula:
C8H7BrFNO2
Molecular Weight:
248.0491
MDL Number:
MFCD22565660
SMILES:
COC(=O)c1cc(F)c(cc1N)Br
Properties
Computed Properties
 
Complexity:
203  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

Downstream Synthesis Route
1020717-99-0   
2-amino-4-bromo-5-fluorobenzoicacidmethylester 

[1]Patent:US2015/183802,2015,A1

[2]Patent:WO2015/102929,2015,A1

[3]Patent:EP2913330,2015,A1

1220886-29-2   
2-amino-4-bromo-5-fluorobenzoicacidmethylester 

[1]Patent:WO2015/173329,2015,A1.Locationinpatent:Page/Pagecolumn66

[2]Patent:WO2018/170275,2018,A1.Locationinpatent:Page/Pagecolumn84;86-87

[3]Patent:WO2016/20836,2016,A1.Locationinpatent:Page/Pagecolumn102;103

[4]Patent:EP2913330,2015,A1.Locationinpatent:Paragraph0338

[5]Patent:US2019/194174,2019,A1.Locationinpatent:Paragraph0754

[6]Patent:US2015/183802,2015,A1.Locationinpatent:Paragraph1180-1182

[7]Patent:WO2015/102929,2015,A1.Locationinpatent:Page/Pagecolumn139

[8]BioorganicandMedicinalChemistryLetters,2019,vol.29,p.2516-2524

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US2015/183802,2015,A1

[2]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2015/102929,2015,A1

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US2015/183802,2015,A1

[2]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2015/102929,2015,A1

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US2015/183802,2015,A1

[2]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2015/102929,2015,A1

Literature
Quotation Request
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SDS
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Tags:1395493-30-7 Molecular Formula|1395493-30-7 MDL|1395493-30-7 SMILES|1395493-30-7 2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester
Catalog No.: AA001B5U
1395493-30-7,MFCD22565660
1395493-30-7 | 2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester
Pack Size： 250mg
Purity： 95%
in stock
$22.00 $16.00
Pack Size： 1g
Purity： 95%
in stock
$25.00 $18.00
Pack Size： 5g
Purity： 95%
in stock
$116.00 $81.00
Pack Size： 25g
Purity： 95%
in stock
$390.00 $273.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA001B5U
Chemical Name: 2-Amino-4-bromo-5-fluoro-benzoic acid methyl ester
CAS Number: 1395493-30-7
Molecular Formula: C8H7BrFNO2
Molecular Weight: 248.0491
MDL Number: MFCD22565660
SMILES: COC(=O)c1cc(F)c(cc1N)Br
Properties
Complexity: 203  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
Downstream Synthesis Route
1020717-99-0   
2-amino-4-bromo-5-fluorobenzoicacidmethylester 

[1]Patent:US2015/183802,2015,A1

[2]Patent:WO2015/102929,2015,A1

[3]Patent:EP2913330,2015,A1

1220886-29-2   
2-amino-4-bromo-5-fluorobenzoicacidmethylester 

[1]Patent:WO2015/173329,2015,A1.Locationinpatent:Page/Pagecolumn66

[2]Patent:WO2018/170275,2018,A1.Locationinpatent:Page/Pagecolumn84;86-87

[3]Patent:WO2016/20836,2016,A1.Locationinpatent:Page/Pagecolumn102;103

[4]Patent:EP2913330,2015,A1.Locationinpatent:Paragraph0338

[5]Patent:US2019/194174,2019,A1.Locationinpatent:Paragraph0754

[6]Patent:US2015/183802,2015,A1.Locationinpatent:Paragraph1180-1182

[7]Patent:WO2015/102929,2015,A1.Locationinpatent:Page/Pagecolumn139

[8]BioorganicandMedicinalChemistryLetters,2019,vol.29,p.2516-2524

1395493-30-7    1800261-95-3 

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US2015/183802,2015,A1

[2]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2015/102929,2015,A1

1395493-30-7    1800261-96-4 

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US2015/183802,2015,A1

[2]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2015/102929,2015,A1

1395493-30-7    1800261-91-9 

[1]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US2015/183802,2015,A1

[2]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-WO2015/102929,2015,A1

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