CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless liquid; cofee-like aroma |
---|---|
Boiling Point | 95.00 to 97.00 °C. @ 10.00 mm Hg |
Solubility | Insoluble in water,soluble in organic solvents |
Density | 1.089-1.111 (20°) |
Refractive Index | 1.506-1.521 |
COMPUTED DESCRIPTORS
Molecular Weight | 170.23 g/mol |
---|---|
XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 4 |
Exact Mass | 170.04015073 g/mol |
Monoisotopic Mass | 170.04015073 g/mol |
Topological Polar Surface Area | 55.5 Ų |
Heavy Atom Count | 11 |
Formal Charge | 0 |
Complexity | 136 |
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
S-(2-Furanylmethyl) propanethioate is a heteroarene.