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55990-13-1,MFCD02704635
Catalog No.:AA00DBEV

55990-13-1 | 2-(3-Amino-benzenesulfonylamino)-benzoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$167.00   $117.00
- +
5g
95%
in stock  
$543.00   $380.00
- +
10g
95%
in stock  
$877.00 $614.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00DBEV
Chemical Name:
2-(3-Amino-benzenesulfonylamino)-benzoic acid
CAS Number:
55990-13-1
Molecular Formula:
C13H12N2O4S
Molecular Weight:
292.3104
MDL Number:
MFCD02704635
SMILES:
Nc1cccc(c1)S(=O)(=O)Nc1ccccc1C(=O)O
Properties
Properties
 
BP:
554.6°C at 760 mmHg  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
446  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Crossley;Northey;Hultquist[JournaloftheAmericanChemicalSociety,1938,vol.60,p.2217,2219]

[1]Bravo,Yalda;Teriete,Peter;Dhanya,Raveendra-Panickar;Dahl,Russell;Lee,PooiSan;Kiffer-Moreira,Tina;Ganji,SanthiReddy;Sergienko,Eduard;Smith,LaytonH.;Farquharson,Colin;Millan,JoseLuis;Cosford,NicholasD.P.[BioorganicandMedicinalChemistryLetters,2014,vol.24,#17,p.4308-4311]

[1]Bravo,Yalda;Teriete,Peter;Dhanya,Raveendra-Panickar;Dahl,Russell;Lee,PooiSan;Kiffer-Moreira,Tina;Ganji,SanthiReddy;Sergienko,Eduard;Smith,LaytonH.;Farquharson,Colin;Millan,JoseLuis;Cosford,NicholasD.P.[BioorganicandMedicinalChemistryLetters,2014,vol.24,#17,p.4308-4311]

Literature
Quotation Request
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Additional Info:
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SDS
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Tags:55990-13-1 Molecular Formula|55990-13-1 MDL|55990-13-1 SMILES|55990-13-1 2-(3-Amino-benzenesulfonylamino)-benzoic acid
Catalog No.: AA00DBEV
55990-13-1,MFCD02704635
55990-13-1 | 2-(3-Amino-benzenesulfonylamino)-benzoic acid
Pack Size： 1g
Purity： 95%
in stock
$167.00 $117.00
Pack Size： 5g
Purity： 95%
in stock
$543.00 $380.00
Pack Size： 10g
Purity： 95%
in stock
$877.00 $614.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00DBEV
Chemical Name: 2-(3-Amino-benzenesulfonylamino)-benzoic acid
CAS Number: 55990-13-1
Molecular Formula: C13H12N2O4S
Molecular Weight: 292.3104
MDL Number: MFCD02704635
SMILES: Nc1cccc(c1)S(=O)(=O)Nc1ccccc1C(=O)O
Properties
BP: 554.6°C at 760 mmHg  
Storage: Keep in dry area;2-8℃;  
Complexity: 446  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 20  
Hydrogen Bond Acceptor Count: 6  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.8  
Downstream Synthesis Route
121-51-7    55990-13-1 

[1]Crossley;Northey;Hultquist[JournaloftheAmericanChemicalSociety,1938,vol.60,p.2217,2219]

55990-13-1    4892-02-8    521318-69-4 

[1]Bravo,Yalda;Teriete,Peter;Dhanya,Raveendra-Panickar;Dahl,Russell;Lee,PooiSan;Kiffer-Moreira,Tina;Ganji,SanthiReddy;Sergienko,Eduard;Smith,LaytonH.;Farquharson,Colin;Millan,JoseLuis;Cosford,NicholasD.P.[BioorganicandMedicinalChemistryLetters,2014,vol.24,#17,p.4308-4311]

55990-13-1    4892-02-8    1622393-04-7 

[1]Bravo,Yalda;Teriete,Peter;Dhanya,Raveendra-Panickar;Dahl,Russell;Lee,PooiSan;Kiffer-Moreira,Tina;Ganji,SanthiReddy;Sergienko,Eduard;Smith,LaytonH.;Farquharson,Colin;Millan,JoseLuis;Cosford,NicholasD.P.[BioorganicandMedicinalChemistryLetters,2014,vol.24,#17,p.4308-4311]

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