CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Yellow solid; [HSDB] |
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Color/Form | YELLOW CRYSTALS |
Boiling Point | 298 °C |
Solubility | SLIGHTLY SOL IN WATER |
Density | 1.018 AT 13 °C |
Refractive Index | INDEX OF REFRACTION: 1.573; SADTLER REFERENCE NUMBER: 24492 (IR, PRISM); 4752 (IR, GRATING); 8634 (UV) |
Kovats Retention Index | 1633.9 1667.7 1638 1670 |
Chemical Classes | Nitrogen Compounds -> Amines, Polyaromatic |
COMPUTED DESCRIPTORS
Molecular Weight | 225.33 g/mol |
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XLogP3 | 3.6 |
Hydrogen Bond Donor Count | 1 |
Hydrogen Bond Acceptor Count | 1 |
Rotatable Bond Count | 4 |
Exact Mass | 225.151749610 g/mol |
Monoisotopic Mass | 225.151749610 g/mol |
Topological Polar Surface Area | 12 Ų |
Heavy Atom Count | 17 |
Formal Charge | 0 |
Complexity | 180 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 2 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |