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2D Structure

Nitromethane


  • SKU Code: CH136818
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Chemical Name - Nitromethane
Mol Weight - 61.0398
Smiles - C[N+]([O-])=O
Property Name Property Value
Mol NameNitromethane
Molweight61.0398
Monoisotopic Mass61.016379
Clogp-0.9609
Clogs-0.604
H Acceptors3
Total Surface Area49.43
Relative Psa0.61542
Polar Surface Area45.82
Druglikeness-5.2
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.75
Fragments1
Non H Atoms4
Non Ch Atoms3
Electronegative Atoms3
Sp3 Atoms2
Acidic Oxygens1
SmilesC[N+]([O-])=O
InChIKey
InChICH3NO2

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