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Chem 3 Methyl Salicylic Acid Methyl Ester 3-Methyl Salicylic Acid Methyl Ester 176 | Buy Chemicals | Chemryt

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3-Methyl Salicylic Acid Methyl Ester


  • SKU Code: CH137020
Chemical Name - 3-Methyl Salicylic Acid Methyl Ester
Mol Weight - 166.175
Smiles - Cc1cccc(C(OC)=O)c1O
Property Name Property Value
Mol Name3-Methyl Salicylic Acid Methyl Ester
Molweight166.175
Monoisotopic Mass166.062995
Clogp1.5708
Clogs-1.805
H Acceptors3
H Donors1
Total Surface Area131.88
Relative Psa0.27404
Polar Surface Area46.53
Druglikeness-3.8376
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritanthigh
Shape Index0.58333
Molecular Flexibility0.37502
Molecular Complexity0.68515
Fragments1
Non H Atoms12
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds2
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms4
SmilesCc1cccc(C(OC)=O)c1O
InChIKeyInChI=1S/C9H10O3/c1-6-4-3-5-7(8(6)10)9(11)12-2/h3-5,10H,1-2H3
InChISUHLUMKZPUMAFP-UHFFFAOYSA-N

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