618-45-1
3-isopropylphenol
CAS: 618-45-1
Molecular Formula: C9H12O
618-45-1 - Names and Identifiers
| Name | 3-isopropylphenol |
| Synonyms | 3-isopropylphenol META-ISOPROPYLPHENOL Isopropylphenol, meta 3-(propan-2-yl)phenol 3-(1-methylethyl)-pheno 3-(1-Methylethyl)phenol 3-(1-methylethyl)-Phenol 3-isopropylhydroxybenzene |
| CAS | 618-45-1 |
| EINECS | 210-551-0 |
| InChI | InChI=1/C9H12O/c1-7(2)8-4-3-5-9(10)6-8/h3-7,10H,1-2H3 |
618-45-1 - Physico-chemical Properties
| Molecular Formula | C9H12O |
| Molar Mass | 136.19 |
| Density | 0.994g/mLat 25°C(lit.) |
| Melting Point | 25°C(lit.) |
| Boling Point | 228°C(lit.) |
| Flash Point | 220°F |
| Vapor Presure | 0.0499mmHg at 25°C |
| Color | white to brown |
| pKa | 10.03±0.10(Predicted) |
| Refractive Index | n20/D 1.526(lit.) |
| Physical and Chemical Properties | It is liquid at room temperature. The melting point is 26 °c, the boiling point is 228 °c, the refractive index is 1.5261, and the flash point is 97 °c. Soluble in ether, slightly soluble in water. |
618-45-1 - Risk and Safety
| Risk Codes | R22 - Harmful if swallowed R34 - Causes burns |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S28 - After contact with skin, wash immediately with plenty of soap-suds. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S27 - Take off immediately all contaminated clothing. |
| UN IDs | UN 2430 8/PG 2 |
| WGK Germany | 3 |
| RTECS | SL5800000 |
| Hazard Class | 8 |
| Packing Group | III |
618-45-1 - Reference Information
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| use | this product is an intermediate of carbamate grass killing agent isoprocarb. |
| production method | is obtained by oxidation and decomposition from m-dicumyl benzene. m-dicumyl can be derived from the by-products of the cumene method for the synthesis of aviation oil, and can also be derived from the by-products of the cumene method for the synthesis of phenol and acetone. In the first step, diisopropylbenzene is oxidized in liquid phase with air under the action of initiator, the reaction temperature is 120 ℃, and the reaction time is 1.0-1.4h. Then the oxidation solution is enriched, and the obtained m-diisopropylbenzene monohydroperoxide is decomposed into m-isopropylphenol and acetone under sulfuric acid catalysis; finally, the finished product is separated and acetone is produced in parallel. |
| category | corroded articles |
| toxicity classification | poisoning |
| acute toxicity | oral-mouse LD50: 1630 mg/kg |
| explosive hazard characteristics | corrosive to skin and cornea |
| flammability hazard characteristics | flammability; gas stimulated by thermal decomposition |
| storage and transportation characteristics | warehouse ventilation and low temperature drying; Store separately from oxidant. |
| fire extinguishing agent | sand, dry powder, foam, carbon dioxide |
Last Update：2024-04-09 20:48:19
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