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2D Structure

1,4-Dibromobutane


  • SKU Code: CH137079
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Chemical Name - 1,4-Dibromobutane
Mol Weight - 215.916
Smiles - BrCCCCBr
Property Name Property Value
Mol Name1,4-Dibromobutane
Molweight215.916
Monoisotopic Mass213.899272
Clogp2.6066
Clogs-2.61
Total Surface Area105.8
Druglikeness-15.89
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Shape Index1
Molecular Flexibility0.59787
Molecular Complexity0.69315
Fragments1
Non H Atoms6
Non Ch Atoms2
Electronegative Atoms2
Rotatable Bonds3
Sp3 Atoms4
Symmetric Atoms3
SmilesBrCCCCBr
InChIKeyInChI=1S/C4H8Br2/c5-3-1-2-4-6/h1-4H2
InChIULTHEAFYOOPTTB-UHFFFAOYSA-N

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