CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Straw coloured liquid; pungent roasted sulfury aroma |
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Boiling Point | 120.00 °C. @ 0.50 mm Hg |
Solubility | Insoluble in water; soluble in fat |
Density | 1.121-1.138 |
Refractive Index | 1.500-1.509 |
COMPUTED DESCRIPTORS
Molecular Weight | 214.28 g/mol |
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XLogP3 | 1.7 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 4 |
Rotatable Bond Count | 7 |
Exact Mass | 214.06636548 g/mol |
Monoisotopic Mass | 214.06636548 g/mol |
Topological Polar Surface Area | 64.7 Ų |
Heavy Atom Count | 14 |
Formal Charge | 0 |
Complexity | 173 |
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
Ethyl 3-[(2-furanylmethyl)thio]propanoate is a heteroarene.