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Chem Beta Phenyl Ethyl Amine | Cheminformatics

Beta Phenyl Ethyl Amine


  • SKU Code: CH137818
Chemical Name - Beta Phenyl Ethyl Amine
Mol Weight - 121.182
Smiles - NCCc1ccccc1
Property Name Property Value
Mol NameBeta Phenyl Ethyl Amine
Molweight121.182
Monoisotopic Mass121.089149
Clogp1.0946
Clogs-1.688
H Acceptors1
H Donors1
Total Surface Area109.3
Relative Psa0.13971
Polar Surface Area26.02
Druglikeness-2.3195
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantlow
Shape Index0.77778
Molecular Flexibility0.41277
Molecular Complexity0.57565
Fragments1
Non H Atoms9
Non Ch Atoms1
Electronegative Atoms1
Rotatable Bonds2
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms3
Symmetric Atoms2
Amines1
Alkyl Amines1
Basic Nitrogens1
SmilesNCCc1ccccc1
InChIKeyInChI=1S/C8H11N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6-7,9H2
InChIBHHGXPLMPWCGHP-UHFFFAOYSA-N

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1 - Beta Phenyl Ethyl Amine
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