CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | colourless oily liquid with a fruity, berry, woody, raisin odour |
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Boiling Point | 158.00 to 160.00 °C. @ 10.00 mm Hg |
Solubility | insoluble in water, soluble in organic solvents, oils |
Density | 0.931-0.937 |
Refractive Index | 1.490-1.495 |
COMPUTED DESCRIPTORS
Molecular Weight | 204.31 g/mol |
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XLogP3 | 3.6 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 6 |
Exact Mass | 204.151415257 g/mol |
Monoisotopic Mass | 204.151415257 g/mol |
Topological Polar Surface Area | 17.1 Ų |
Heavy Atom Count | 15 |
Formal Charge | 0 |
Complexity | 180 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 1 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3-Benzyl-4-heptanone is a member of benzenes.