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Chem Ortho Nitro Chloro Benzene | Cheminformatics

Ortho Nitro Chloro Benzene


  • SKU Code: CH136973
Chemical Name - Ortho Nitro Chloro Benzene
Mol Weight - 157.556
Smiles - [O-][N+](c(cccc1)c1Cl)=O
Property Name Property Value
Mol NameOrtho Nitro Chloro Benzene
Molweight157.556
Monoisotopic Mass156.993056
Clogp1.344
Clogs-2.812
H Acceptors3
Total Surface Area112.35
Relative Psa0.27076
Polar Surface Area45.82
Druglikeness-7.4592
Mutagenicnone
Tumorigenicnone
Reproductive Effectivehigh
Irritantnone
Shape Index0.6
Molecular Flexibility0.3819
Molecular Complexity0.6868
Fragments1
Non H Atoms10
Non Ch Atoms4
Electronegative Atoms4
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms1
Acidic Oxygens1
Smiles[O-][N+](c(cccc1)c1Cl)=O
InChIKeyInChI=1S/C6H4ClNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H
InChIBFCFYVKQTRLZHA-UHFFFAOYSA-N

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