527-84-4
Product Name:
O-CYMENE
Formula:
C10H14
Synonyms:
1-Isopropyl-2-methylbenzene;2-Isopropyltoluene
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Colorless liquid; [Hawley] Clear nearly colorless liquid; [MSDSonline] |
|---|---|
| Color/Form | Liquid |
| Boiling Point | 178 °C |
| Melting Point | -71.5 °C |
| Solubility | In water, 23.3 mg/L at 25 °C |
| Density | 0.8766 g/cu cm at 20 °C |
| Vapor Pressure | 1.5 [mmHg] |
| LogP | log Kow = 4.26 |
| Stability/Shelf Life | Stable under recommended storage conditions. |
| Decomposition | When heated to decomposition it emits acrid smoke and irritating vapors. |
| Refractive Index | Index of refraction: 1.5006 at 20 °C/D |
| Kovats Retention Index | 1025.4 1051.3 1020.4 1022.7 1028 1024 1009.85 1029 1029 1031 1029 1028 1028 1029 1030 1020.6 1028 1032 1045 1032.3 1038.4 1044.9 1016.9 1033 1016.9 1032 1021 1028 1017 1009 1022 1014 1016 1019 1016 1038 1024 1013.2 1012.3 1015.8 1067.7 1037.1 1016 1034 1017 1029 1024 1026.6 1021 1022 1020 1017 |
| Other Experimental Properties | Colorless, transparent liquids /Cymenes/ |
| Chemical Classes | Solvents -> Aromatic Solvents |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Flame Flammables GHS02 |
| GHS Hazard Statements |
H226:Flammable liquids |
| Precautionary Statement Codes |
P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking. P233:Keep container tightly closed. P240:Ground/bond container and receiving equipment. P241:Use explosion-proof electrical/ventilating/lighting/…/equipment. P242:Use only non-sparking tools. P243:Take precautionary measures against static discharge. |
COMPUTED DESCRIPTORS
| Molecular Weight | 134.22 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 0 |
| Rotatable Bond Count | 1 |
| Exact Mass | 134.109550447 g/mol |
| Monoisotopic Mass | 134.109550447 g/mol |
| Topological Polar Surface Area | 0 Ų |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Complexity | 94.2 |
| 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 |