CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Riddelline is a colorless to off-white crystalline solid. Starts turning brown at approximately 329 °F; is blackish-brown at melting point. (NTP, 1992) |
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Melting Point | 369 °F (NTP, 1992) |
Solubility | less than 1 mg/mL at 77 °F (NTP, 1992) |
Stability/Shelf Life | Stability: stable at room temperature in closed containers: best stored under nitrogen -15 °C. |
Decomposition | When heated to decomposition it emits toxic fumes of /nitrogen oxide/. |
Chemical Classes | Biological Agents -> Plant Toxins |
COMPUTED DESCRIPTORS
Molecular Weight | 349.4 g/mol |
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XLogP3 | 0.2 |
Hydrogen Bond Donor Count | 2 |
Hydrogen Bond Acceptor Count | 7 |
Rotatable Bond Count | 1 |
Exact Mass | 349.15253745 g/mol |
Monoisotopic Mass | 349.15253745 g/mol |
Topological Polar Surface Area | 96.3 Ų |
Heavy Atom Count | 25 |
Formal Charge | 0 |
Complexity | 667 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 3 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Riddelline is a colorless to off-white crystalline solid. Starts turning brown at approximately 329 °F; is blackish-brown at melting point. (NTP, 1992)