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Chem 2 Ethoxy Benzoic Acid Ethyl Ester | Cheminformatics

2-Ethoxy Benzoic Acid Ethyl Ester


  • SKU Code: CH137025
Chemical Name - 2-Ethoxy Benzoic Acid Ethyl Ester
Mol Weight - 194.229
Smiles - CCOC(c(cccc1)c1OCC)=O
Property Name Property Value
Mol Name2-Ethoxy Benzoic Acid Ethyl Ester
Molweight194.229
Monoisotopic Mass194.094295
Clogp2.3152
Clogs-2.375
H Acceptors3
Total Surface Area163.05
Relative Psa0.20264
Polar Surface Area35.53
Druglikeness-5.4625
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Shape Index0.64286
Molecular Flexibility0.47302
Molecular Complexity0.62778
Fragments1
Non H Atoms14
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds5
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms6
SmilesCCOC(c(cccc1)c1OCC)=O
InChIKeyInChI=1S/C11H14O3/c1-3-13-10-8-6-5-7-9(10)11(12)14-4-2/h5-8H,3-4H2,1-2H3
InChIOUZCDRGUTZLAGO-UHFFFAOYSA-N

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