Home Carboxys 1H-Pyrrole-2,5-dicarboxylic acid

1H-Pyrrole-2,5-dicarboxylic acid

CAS No.:
937-27-9
Catalog Number:
AG006EMK
Molecular Formula:
C6H5NO4
Molecular Weight:
155.1082
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$100
- +
1g
95%
In Stock USA
United States
$238
- +
5g
95%
In Stock USA
United States
$950
- +
Product Description
Catalog Number:
AG006EMK
Chemical Name:
1H-Pyrrole-2,5-dicarboxylic acid
CAS Number:
937-27-9
Molecular Formula:
C6H5NO4
Molecular Weight:
155.1082
MDL Number:
MFCD09991932
IUPAC Name:
1H-pyrrole-2,5-dicarboxylic acid
InChI:
InChI=1S/C6H5NO4/c8-5(9)3-1-2-4(7-3)6(10)11/h1-2,7H,(H,8,9)(H,10,11)
InChI Key:
JLUIOEOHOOLSJC-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc([nH]1)C(=O)O
Properties
Complexity:
171  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.022g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
155.109g/mol
Monoisotopic Mass:
155.022g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
90.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
A direct preparation of N-unsubstituted pyrrole-2,5-dicarboxylates from 2-azidocarboxylic esters. Organic letters 20091001
Properties