COMPUTED DESCRIPTORS
Molecular Weight | 146.25 g/mol |
---|---|
XLogP3 | 2 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 3 |
Exact Mass | 146.07653624 g/mol |
Monoisotopic Mass | 146.07653624 g/mol |
Topological Polar Surface Area | 42.4 Ų |
Heavy Atom Count | 9 |
Formal Charge | 0 |
Complexity | 102 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
3,3-dimethyl-1-(methylsulfanyl)butan-2-one is a butanone and an aliphatic sulfide.