CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | 3-amino-6-methylphenol is a brown powder. (NTP, 1992) |
|---|---|
| Color/Form | Plates from water |
| Melting Point | 320 to 347 °F (sublimes) (NTP, 1992) |
| Solubility | less than 1 mg/mL at 70 °F (NTP, 1992) |
| Vapor Pressure | 0.00026 [mmHg] |
| LogP | log Kow = 0.79 /Estimated/ |
| Henry's Law Constant | Henry's Law constant: 2.19X10-10 atm-cu m/mole @ 25 °C /Estimated/ |
| Stability/Shelf Life | Stable |
| Decomposition | When heated to decomposition it emits toxic fumes of /nitrogen oxide/. |
| Other Experimental Properties | Hydroxyl radical reaction rate constant: 2.00X10-10 cu cm/molecule-sec @ 25 °C /Estimated/ |
| Chemical Classes | Nitrogen Compounds -> Amino Phenols |
COMPUTED DESCRIPTORS
| Molecular Weight | 123.15 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 123.068413911 g/mol |
| Monoisotopic Mass | 123.068413911 g/mol |
| Topological Polar Surface Area | 46.2 Ų |
| Heavy Atom Count | 9 |
| Formal Charge | 0 |
| Complexity | 94.9 |
| 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
3-amino-6-methylphenol is a brown powder. (NTP, 1992)