CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Colourless to yellow orange liquid; honey rose aroma |
---|---|
Boiling Point | 169.00 °C. @ 30.00 mm Hg |
Solubility | Insoluble in water; Soluble in oils |
Density | 1.138-1.150 |
Refractive Index | 1.540-1.550 |
Kovats Retention Index | 1760 |
COMPUTED DESCRIPTORS
Molecular Weight | 216.23 g/mol |
---|---|
XLogP3 | 3.1 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 5 |
Exact Mass | 216.078644241 g/mol |
Monoisotopic Mass | 216.078644241 g/mol |
Topological Polar Surface Area | 39.4 Ų |
Heavy Atom Count | 16 |
Formal Charge | 0 |
Complexity | 221 |
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
2-Phenylethyl 2-furancarboxylate is a carboxylic ester. It is functionally related to a 2-furoic acid.