Home Nitros 2,3-dimethyl-5-nitropyridin-4-ol

2,3-dimethyl-5-nitropyridin-4-ol

CAS No.:
68707-72-2
Catalog Number:
AG01C2K5
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
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Product Description
Catalog Number:
AG01C2K5
Chemical Name:
2,3-dimethyl-5-nitropyridin-4-ol
CAS Number:
68707-72-2
Molecular Formula:
C7H8N2O3
Molecular Weight:
168.1500
MDL Number:
MFCD18803386
IUPAC Name:
2,3-dimethyl-5-nitro-1H-pyridin-4-one
InChI:
InChI=1S/C7H8N2O3/c1-4-5(2)8-3-6(7(4)10)9(11)12/h3H,1-2H3,(H,8,10)
InChI Key:
WFKHHAYANCSHGZ-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cnc(c(c1O)C)C
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.053g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
168.152g/mol
Monoisotopic Mass:
168.053g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties