5495-84-1
Product Name:
2-Isopropylthioxanthone
Formula:
C16H14OS
Synonyms:
2-Isopropyl-9H-thioxanthen-9-one
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | NKRA; Pellets or Large Crystals |
|---|---|
| Kovats Retention Index | 2345 2353 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H302:Acute toxicity,oral |
| Precautionary Statement Codes |
P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P270:Do not eat, drink or smoke when using this product. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 254.3 g/mol |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 1 |
| Exact Mass | 254.07653624 g/mol |
| Monoisotopic Mass | 254.07653624 g/mol |
| Topological Polar Surface Area | 42.4 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 325 |
| 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 |