Home Carboxys Methyl 5-nitro-1h-pyrrolo[2,3-b]pyridine-2-carboxylate

Methyl 5-nitro-1h-pyrrolo[2,3-b]pyridine-2-carboxylate

CAS No.:
952182-17-1
Catalog Number:
AG005SO4
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$374
- +
5g
95%
1 week
United States
$1048
- +
10g
95%
1 week
United States
$1721
- +
Product Description
Catalog Number:
AG005SO4
Chemical Name:
Methyl 5-nitro-1h-pyrrolo[2,3-b]pyridine-2-carboxylate
CAS Number:
952182-17-1
Molecular Formula:
C9H7N3O4
Molecular Weight:
221.1696
MDL Number:
MFCD09841658
IUPAC Name:
methyl 5-nitro-1H-pyrrolo[2,3-b]pyridine-2-carboxylate
InChI:
InChI=1S/C9H7N3O4/c1-16-9(13)7-3-5-2-6(12(14)15)4-10-8(5)11-7/h2-4H,1H3,(H,10,11)
InChI Key:
WWCIKRATXUMSLS-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c([nH]1)ncc(c2)[N+](=O)[O-]
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.044g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.172g/mol
Monoisotopic Mass:
221.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties