Home Carboxys Ethyl 5-nitro-1h-pyrrole-2-carboxylate

Ethyl 5-nitro-1h-pyrrole-2-carboxylate

CAS No.:
36131-46-1
Catalog Number:
AG007BDL
Molecular Formula:
C7H8N2O4
Molecular Weight:
184.1494
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$150
- +
1g
95%
In Stock USA
United States
$335
- +
Product Description
Catalog Number:
AG007BDL
Chemical Name:
Ethyl 5-nitro-1h-pyrrole-2-carboxylate
CAS Number:
36131-46-1
Molecular Formula:
C7H8N2O4
Molecular Weight:
184.1494
MDL Number:
MFCD09025771
IUPAC Name:
ethyl 5-nitro-1H-pyrrole-2-carboxylate
InChI:
InChI=1S/C7H8N2O4/c1-2-13-7(10)5-3-4-6(8-5)9(11)12/h3-4,8H,2H2,1H3
InChI Key:
CVUNOXYEWWXPCU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc([nH]1)C(=O)OCC
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.048g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
184.151g/mol
Monoisotopic Mass:
184.048g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties