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Feature4-methylheptaneAcetone
FormuladiffersC8H18C3H6O
Molar massdiffers114.232 g·mol−158.08 g·mol−1
Exact massdiffers114.1408558.041864811
DBEdiffers01
H-bond donorsdiffersNot available0
H-bond acceptorsdiffersNot available1
TPSAdiffersNot available17.1
logPdiffersNot available-0.1 (PubChem computed XLogP3-AA descriptor)
Melting pointNot availableNot available
Boiling pointdiffersNot available56.05 deg C (1 atm)
DensitydiffersNot available0.7845 g/mL (25 deg C)
Functional groupsdiffersAlkane / alkyl carbonKetone
Available spectradiffersNonesimulated IR
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