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6127-11-3,MFCD05663950
Catalog No.:AA003KUO

6127-11-3 | 2-(4-Bromo-2-nitrophenyl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$35.00   $25.00
- +
5g
97%
in stock  
$52.00   $37.00
- +
10g
97%
in stock  
$83.00   $58.00
- +
25g
97%
in stock  
$158.00   $111.00
- +
100g
97%
in stock  
$555.00   $388.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003KUO
Chemical Name:
2-(4-Bromo-2-nitrophenyl)acetic acid
CAS Number:
6127-11-3
Molecular Formula:
C8H6BrNO4
Molecular Weight:
260.0415
MDL Number:
MFCD05663950
SMILES:
OC(=O)Cc1ccc(cc1[N+](=O)[O-])Br
NSC Number:
115142
Properties
Properties
 
BP:
392°C at 760 mmHg  
Form:
Solid  
MP:
156-160°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
240  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
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:
1.9  

Upstream Synthesis Route

[1]Patent:WO2008/73480,2008,A1,.Locationinpatent:Page/Pagecolumn27-28

[2]Patent:EP2108641,2009,A1,.Locationinpatent:Page/Pagecolumn29

[3]Patent:EP2113503,2009,A1,.Locationinpatent:Page/Pagecolumn21

[4]Patent:US2003/69421,2003,A1,

[5]Patent:US6486185,2002,B1,

[6]Patent:US6051593,2000,A,

[7]Patent:US6114371,2000,A,

[8]Patent:US6395734,2002,B1,

[9]Patent:US6878733,2005,B1,.Locationinpatent:Page/Pagecolumn177;228

[10]Patent:US6350754,2002,B2,.Locationinpatent:Pagecolumn29

[11]Patent:US2004/186160,2004,A1,.Locationinpatent:Page/Pagecolumn23

[12]Patent:WO2006/52936,2006,A2,.Locationinpatent:Page/Pagecolumn48

[1]Patent:WO2005/63767,2005,A2,.Locationinpatent:Page/Pagecolumn44

[2]Patent:US2007/78147,2007,A1,.Locationinpatent:Page/Pagecolumn72

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,#4,p.1414-1418

[2]Patent:US6268391,2001,B1,

[1]BioorganicandMedicinalChemistryLetters,2011,vol.21,#14,p.4130-4133

[1]BioorganicandMedicinalChemistryLetters,2011,vol.21,#14,p.4130-4133

[2]ACSMedicinalChemistryLetters,2012,vol.3,#2,p.140-145

Downstream Synthesis Route

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,p.1414-1418

[2]Patent:US6878733,2005,B1.Locationinpatent:Page/Pagecolumn177;228

[3]Patent:US6350754,2002,B2.Locationinpatent:Pagecolumn29

[4]Patent:US2004/186160,2004,A1.Locationinpatent:Page/Pagecolumn23

[5]JournalofChemicalResearch,2008,p.287-288

[6]Patent:US2003/225127,2003,A1.Locationinpatent:Page13

[7]BioorganicandMedicinalChemistryLetters,2011,vol.21,p.4130-4133

[8]Patent:EP2108641,2009,A1.Locationinpatent:Page/Pagecolumn29

[9]Patent:EP2113503,2009,A1.Locationinpatent:Page/Pagecolumn21

[10]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

[11]Patent:US6268391,2001,B1

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,p.1414-1418

[2]Patent:US6268391,2001,B1

4-(4-bromo-2-nitro-phenyl)-3-oxo-butyricacid 
  6127-11-3 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

6127-11-3   
6-Bromo-3-1-(1H-pyrrol-3-yl)-meth-(Z)-ylidene-1,3-dihydro-indol-2-one 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

6127-11-3   
6-Bromo-3-1-(1H-imidazol-2-yl)-meth-(Z)-ylidene-1,3-dihydro-indol-2-one 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

Literature
Quotation Request
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SDS
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Tags:6127-11-3 Molecular Formula|6127-11-3 MDL|6127-11-3 SMILES|6127-11-3 2-(4-Bromo-2-nitrophenyl)acetic acid
Catalog No.: AA003KUO
6127-11-3,MFCD05663950
6127-11-3 | 2-(4-Bromo-2-nitrophenyl)acetic acid
Pack Size： 1g
Purity： 98%
in stock
$35.00 $25.00
Pack Size： 5g
Purity： 97%
in stock
$52.00 $37.00
Pack Size： 10g
Purity： 97%
in stock
$83.00 $58.00
Pack Size： 25g
Purity： 97%
in stock
$158.00 $111.00
Pack Size： 100g
Purity： 97%
in stock
$555.00 $388.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003KUO
Chemical Name: 2-(4-Bromo-2-nitrophenyl)acetic acid
CAS Number: 6127-11-3
Molecular Formula: C8H6BrNO4
Molecular Weight: 260.0415
MDL Number: MFCD05663950
SMILES: OC(=O)Cc1ccc(cc1[N+](=O)[O-])Br
NSC Number: 115142
Properties
BP: 392°C at 760 mmHg  
Form: Solid  
MP: 156-160°C  
Storage: Keep in dry area;Room Temperature;  
Complexity: 240  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
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: 1.9  
Upstream Synthesis Route
100487-81-8    6127-11-3 

[1]Patent:WO2008/73480,2008,A1,.Locationinpatent:Page/Pagecolumn27-28

[2]Patent:EP2108641,2009,A1,.Locationinpatent:Page/Pagecolumn29

[3]Patent:EP2113503,2009,A1,.Locationinpatent:Page/Pagecolumn21

[4]Patent:US2003/69421,2003,A1,

[5]Patent:US6486185,2002,B1,

[6]Patent:US6051593,2000,A,

[7]Patent:US6114371,2000,A,

[8]Patent:US6395734,2002,B1,

[9]Patent:US6878733,2005,B1,.Locationinpatent:Page/Pagecolumn177;228

[10]Patent:US6350754,2002,B2,.Locationinpatent:Pagecolumn29

[11]Patent:US2004/186160,2004,A1,.Locationinpatent:Page/Pagecolumn23

[12]Patent:WO2006/52936,2006,A2,.Locationinpatent:Page/Pagecolumn48

199328-34-2    6127-11-3 

[1]Patent:WO2005/63767,2005,A2,.Locationinpatent:Page/Pagecolumn44

[2]Patent:US2007/78147,2007,A1,.Locationinpatent:Page/Pagecolumn72

99365-39-6    6127-11-3 

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,#4,p.1414-1418

[2]Patent:US6268391,2001,B1,

100487-82-9    6127-11-3 

[1]BioorganicandMedicinalChemistryLetters,2011,vol.21,#14,p.4130-4133

364-73-8    6127-11-3 

[1]BioorganicandMedicinalChemistryLetters,2011,vol.21,#14,p.4130-4133

[2]ACSMedicinalChemistryLetters,2012,vol.3,#2,p.140-145

Downstream Synthesis Route
6127-11-3    99365-40-9 

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,p.1414-1418

[2]Patent:US6878733,2005,B1.Locationinpatent:Page/Pagecolumn177;228

[3]Patent:US6350754,2002,B2.Locationinpatent:Pagecolumn29

[4]Patent:US2004/186160,2004,A1.Locationinpatent:Page/Pagecolumn23

[5]JournalofChemicalResearch,2008,p.287-288

[6]Patent:US2003/225127,2003,A1.Locationinpatent:Page13

[7]BioorganicandMedicinalChemistryLetters,2011,vol.21,p.4130-4133

[8]Patent:EP2108641,2009,A1.Locationinpatent:Page/Pagecolumn29

[9]Patent:EP2113503,2009,A1.Locationinpatent:Page/Pagecolumn21

[10]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

[11]Patent:US6268391,2001,B1

99365-39-6    6127-11-3 

[1]ChemicalandPharmaceuticalBulletin,1985,vol.33,p.1414-1418

[2]Patent:US6268391,2001,B1

4-(4-bromo-2-nitro-phenyl)-3-oxo-butyricacid 
  6127-11-3 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

6127-11-3   
6-Bromo-3-1-(1H-pyrrol-3-yl)-meth-(Z)-ylidene-1,3-dihydro-indol-2-one 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

6127-11-3   
6-Bromo-3-1-(1H-imidazol-2-yl)-meth-(Z)-ylidene-1,3-dihydro-indol-2-one 

[1]BioorganicandMedicinalChemistryLetters,2006,vol.16,p.421-426

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