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Chem 2 Chloro 5 Nitrobenzoic Acid 2-Chloro-5-nitrobenzoic Acid 179 | Buy Chemicals | Chemryt

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2-Chloro-5-nitrobenzoic Acid


  • SKU Code: CH137099
Chemical Name - 2-Chloro-5-nitrobenzoic Acid
Mol Weight - 201.565
Smiles - [O-][N+](c(cc1)cc(C(O)=O)c1Cl)=O
Property Name Property Value
Mol Name2-Chloro-5-nitrobenzoic Acid
Molweight201.565
Monoisotopic Mass200.982886
Clogp0.8291
Clogs-2.825
H Acceptors5
H Donors1
Total Surface Area136.45
Relative Psa0.41451
Polar Surface Area83.12
Druglikeness-6.775
Mutagenicnone
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Shape Index0.53846
Molecular Flexibility0.46237
Molecular Complexity0.71958
Fragments1
Non H Atoms13
Non Ch Atoms6
Electronegative Atoms6
Rotatable Bonds2
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
Acidic Oxygens2
Smiles[O-][N+](c(cc1)cc(C(O)=O)c1Cl)=O
InChIKeyInChI=1S/C7H4ClNO4/c8-6-2-1-4(9(12)13)3-5(6)7(10)11/h1-3H,(H,10,11)
InChIQUEKGYQTRJVEQC-UHFFFAOYSA-N

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