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2D Structure

Iso-Pentane


  • SKU Code: CH138563
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Chemical Name - Iso-Pentane
Mol Weight - 72.1503
Smiles - CCC(C)C
Property Name Property Value
Mol NameIso-Pentane
Molweight72.1503
Monoisotopic Mass72.0939
Clogp2.1043
Clogs-1.684
Total Surface Area76.54
Druglikeness-2.7601
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.8
Molecular Flexibility0.63571
Molecular Complexity0.34657
Fragments1
Non H Atoms5
Rotatable Bonds1
Sp3 Atoms5
Symmetric Atoms1
SmilesCCC(C)C
InChIKeyInChI=1S/C5H12/c1-4-5(2)3/h5H,4H2,1-3H3
InChIQWTDNUCVQCZILF-UHFFFAOYSA-N

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