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Home > Nitro Compounds > 75710-99-5
75710-99-5 | 3-Methoxy-5-nitropyridin-2-ol
CAS No: 75710-99-5 Catalog No: AG005AHN MDL No:MFCD06658463
Product Description
Catalog Number:
AG005AHN
Chemical Name:
3-Methoxy-5-nitropyridin-2-ol
CAS Number:
75710-99-5
Molecular Formula:
C6H6N2O4
Molecular Weight:
170.1228
MDL Number:
MFCD06658463
IUPAC Name:
3-methoxy-5-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C6H6N2O4/c1-12-5-2-4(8(10)11)3-7-6(5)9/h2-3H,1H3,(H,7,9)
InChI Key:
JDHPYWKDVDFUDW-UHFFFAOYSA-N
SMILES:
COc1cc(cnc1O)[N+](=O)[O-]
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.033g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
170.124g/mol
Monoisotopic Mass:
170.033g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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