Chem Propionyl Bromide - Cheminformatics | Bioinformatics | Life Science - Software Services

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Propionyl Bromide


  • SKU Code: CH137078
Chemical Name - Propionyl Bromide
Mol Weight - 136.976
Smiles - CCC(Br)=O
Property Name Property Value
Mol NamePropionyl Bromide
Molweight136.976
Monoisotopic Mass135.952376
Clogp0.6682
Clogs-0.947
H Acceptors1
Total Surface Area75.9
Relative Psa0.17181
Polar Surface Area17.07
Druglikeness-5.4499
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.8
Molecular Flexibility0.61655
Molecular Complexity0.69315
Fragments1
Non H Atoms5
Non Ch Atoms2
Electronegative Atoms2
Rotatable Bonds1
Sp3 Atoms2
SmilesCCC(Br)=O
InChIKeyInChI=1S/C3H5BrO/c1-2-3(4)5/h2H2,1H3
InChIRIBFXMJCUYXJDZ-UHFFFAOYSA-N

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