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Chem 235 Trimethyl 4 Nitropyridine 1 Oxide 2,3,5-Trimethyl-4-Nitropyridine-1-Oxide 179 | Buy Chemicals | Chemryt

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2,3,5-Trimethyl-4-Nitropyridine-1-Oxide


  • SKU Code: CH137098
Chemical Name - 2,3,5-Trimethyl-4-Nitropyridine-1-Oxide
Mol Weight - 182.178
Smiles - Cc1c[n+]([O-])c(C)c(C)c1[N+]([O-])=O
Property Name Property Value
Mol Name2,3,5-Trimethyl-4-Nitropyridine-1-Oxide
Molweight182.178
Monoisotopic Mass182.069143
Clogp0.3473
Clogs-4.721
H Acceptors5
Total Surface Area135.76
Relative Psa0.32911
Polar Surface Area71.28
Druglikeness-7.6962
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.53846
Molecular Flexibility0.32005
Molecular Complexity0.74622
Fragments1
Non H Atoms13
Non Ch Atoms5
Electronegative Atoms5
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms5
Aromatic Nitrogens1
Acidic Oxygens2
SmilesCc1c[n+]([O-])c(C)c(C)c1[N+]([O-])=O
InChIKeyInChI=1S/C8H10N2O3/c1-5-4-9(11)7(3)6(2)8(5)10(12)13/h4H,1-3H3
InChIYMBLTOGTYNFTRX-UHFFFAOYSA-N

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