Home Carboxys 2-Pyridinecarboxylicacid,6-methoxy-5-nitro-(9CI)

2-Pyridinecarboxylicacid,6-methoxy-5-nitro-(9CI)

CAS No.:
475272-62-9
Catalog Number:
AG00DGP0
Molecular Formula:
C7H6N2O5
Molecular Weight:
198.1329
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Product Description
Catalog Number:
AG00DGP0
Chemical Name:
2-Pyridinecarboxylicacid,6-methoxy-5-nitro-(9CI)
CAS Number:
475272-62-9
Molecular Formula:
C7H6N2O5
Molecular Weight:
198.1329
MDL Number:
MFCD18261308
IUPAC Name:
6-methoxy-5-nitropyridine-2-carboxylic acid
InChI:
InChI=1S/C7H6N2O5/c1-14-6-5(9(12)13)3-2-4(8-6)7(10)11/h2-3H,1H3,(H,10,11)
InChI Key:
USBYKQLQDLTNGK-UHFFFAOYSA-N
SMILES:
COc1nc(ccc1[N+](=O)[O-])C(=O)O
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
198.134g/mol
Monoisotopic Mass:
198.028g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties