Chem 6 Amino Caproic Acid 2 Molychem | Cheminformatics
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2D Structure

6-Amino Caproic Acid


  • SKU Code: CH140964
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Chemical Name - 6-Amino Caproic Acid
Mol Weight - 131.174
Smiles - NCCCCCC(O)=O
Property Name Property Value
Mol Name6-Amino Caproic Acid
Molweight131.174
Monoisotopic Mass131.094629
Clogp-1.5328
Clogs-1.108
H Acceptors3
H Donors2
Total Surface Area114.92
Relative Psa0.36034
Polar Surface Area63.32
Druglikeness-13.662
Mutagenicnone
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Shape Index0.88889
Molecular Flexibility0.62986
Molecular Complexity0.44794
Fragments1
Non H Atoms9
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds5
Sp3 Atoms7
Amines1
Alkyl Amines1
Basic Nitrogens1
Acidic Oxygens1
SmilesNCCCCCC(O)=O
InChIKeyInChI=1S/C6H13NO2/c7-5-3-1-2-4-6(8)9/h1-5,7H2,(H,8,9)
InChISLXKOJJOQWFEFD-UHFFFAOYSA-N

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