CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless liquid; [MSDSonline] |
|---|---|
| Boiling Point | 210.00 °C. @ 760.00 mm Hg |
| Melting Point | 14 °C |
| Flash Point | [ChemIDplus] 71 °C |
| Solubility | 0.0768 mg/mL at 25 °C |
| Density | 0.821-0.831 (20°) |
| LogP | 3.73 |
| Refractive Index | 1.421-1.431 |
| Kovats Retention Index | 1176 1170.4 1175 1171.1 1179 1171 1168 1172 1174 1169.3 1169.7 1174.9 1178.6 1172 1173 1177 1180 1184 1184 1182 1170 1176 1172 1148 1172 1177 1176 1169 1169 1148 1176.8 1173 1175 1172 1169 1189 1176 1163 1172.4 1171 1159 1174 1176 1162 1160.9 |
| Chemical Classes | Solvents -> Ketones (<C12) |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H227:Flammable liquids H401:Hazardous to the aquatic environment, acute hazard |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P273:Avoid release to the environment. P280:Wear protective gloves/protective clothing/eye protection/face protection. P370+P378:In case of fire: Use … for extinction. P403+P235:Store in a well-ventilated place. Keep cool. P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 156.26 g/mol |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 7 |
| Exact Mass | 156.151415257 g/mol |
| Monoisotopic Mass | 156.151415257 g/mol |
| Topological Polar Surface Area | 17.1 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 97 |
| 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
Decan-2-one is a methyl ketone that is decane in which the methylene hydrogens at position 2 are replaced by an oxo group. It has a role as a plant metabolite. It derives from a hydride of a decane.