Home Carboxys 6-(methylamino)-5-nitropyridine-2-carboxylic acid

6-(methylamino)-5-nitropyridine-2-carboxylic acid

CAS No.:
1600316-11-7
Catalog Number:
AG01A6QS
Molecular Formula:
C7H7N3O4
Molecular Weight:
197.1482
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Product Description
Catalog Number:
AG01A6QS
Chemical Name:
6-(methylamino)-5-nitropyridine-2-carboxylic acid
CAS Number:
1600316-11-7
Molecular Formula:
C7H7N3O4
Molecular Weight:
197.1482
MDL Number:
MFCD29047149
IUPAC Name:
6-(methylamino)-5-nitropyridine-2-carboxylic acid
InChI:
InChI=1S/C7H7N3O4/c1-8-6-5(10(13)14)3-2-4(9-6)7(11)12/h2-3H,1H3,(H,8,9)(H,11,12)
InChI Key:
RLKBOXRZLVUTPV-UHFFFAOYSA-N
SMILES:
CNc1nc(ccc1[N+](=O)[O-])C(=O)O
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.044g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
197.15g/mol
Monoisotopic Mass:
197.044g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties