CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Light yellow powder; [Sigma-Aldrich MSDS] |
|---|---|
| Vapor Pressure | 0.00723 [mmHg] |
| Kovats Retention Index | 1470 1451 |
| Chemical Classes | Other Classes -> Aromatic Ketones |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Health Hazard GHS08 |
| GHS Hazard Statements |
H304:Aspiration hazard H350:Carcinogenicity |
| Precautionary Statement Codes |
P201:Obtain special instructions before use. P202:Do not handle until all safety precautions have been read and understood. P281:Use personal protective equipment as required. P331:Do NOT induce vomiting. P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. P308+P313:IF exposed or concerned: Get medical advice/attention. P403:Store in a well-ventilated place. |
COMPUTED DESCRIPTORS
| Molecular Weight | 162.18 g/mol |
|---|---|
| XLogP3 | 1.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 2 |
| Exact Mass | 162.068079557 g/mol |
| Monoisotopic Mass | 162.068079557 g/mol |
| Topological Polar Surface Area | 34.1 Ų |
| Heavy Atom Count | 12 |
| Formal Charge | 0 |
| Complexity | 166 |
| 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 |