CHEMICAL AND PHYSICAL PROPERTIES
Color/Form | Rectangular plates from acetone-water |
---|---|
Boiling Point | Sublimes in high vacuum between 140 and 170 °C |
Solubility | Soluble in acetone, ethyl acetate |
Optical Rotation | Crystals from ethyl acetate; mp 162-164 °C. Specific optical rotation: -79 deg at 27 °C/D (c = 1.80 in ethyl acetate) /Desmorphine hemihydrate/ |
Decomposition | When heated to decomposition it emits toxic fumes of /oxides of nitrogen/. |
Other Experimental Properties | Anhydrous base, MP 189 °C |
SAFETY INFORMATION
Signal word | Danger |
---|---|
Pictogram(s) |
Flame Flammables GHS02 Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H225:Flammable liquids H319:Serious eye damage/eye irritation |
Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 271.35 g/mol |
---|---|
XLogP3 | 2.8 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 3 |
Rotatable Bond Count | 0 |
Exact Mass | 271.157228913 g/mol |
Monoisotopic Mass | 271.157228913 g/mol |
Topological Polar Surface Area | 32.7 Ų |
Heavy Atom Count | 20 |
Formal Charge | 0 |
Complexity | 427 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 4 |
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
Desomorphine is a morphinane alkaloid.