3452-97-9
3,5,5-trimethyl-1-hexanol
CAS: 3452-97-9
Molecular Formula: C9H20O
3452-97-9 - Names and Identifiers
| Name | 3,5,5-trimethyl-1-hexanol |
| Synonyms | Nonylol i-nonyl i-nonylalcohol Trimethyl-1-hexanol Trimethylhexyl alcohol ISONONYL ALCOHOL, LINEAR 3,5,5-trimethyl-1-hexanol 3,5,5-trimethylhexan-1-ol 3,5,5-Trimethylhexyl Alcohol 3,5,5-Trimethylhexyl alcohol 3,5,5-TRIMETHYLHEXANOL (NONYL ALCOHOL) TECHNICAL |
| CAS | 3452-97-9 |
| EINECS | 222-376-7 |
| InChI | InChI=1/C9H20O/c1-8(5-6-10)7-9(2,3)4/h8,10H,5-7H2,1-4H3/t8-/m0/s1 |
3452-97-9 - Physico-chemical Properties
| Molecular Formula | C9H20O |
| Molar Mass | 144.25 |
| Density | 0.824 g/mL at 25 °C (lit.) |
| Melting Point | 6.15°C (estimate) |
| Boling Point | 193-194 °C (lit.) |
| Flash Point | 178°F |
| JECFA Number | 268 |
| Water Solubility | 450.1mg/L(20 ºC) |
| Vapor Presure | 2hPa at 20℃ |
| Appearance | clear liquid |
| Color | Colorless to Almost colorless |
| pKa | 15.13±0.10(Predicted) |
| Storage Condition | Sealed in dry,Room Temperature |
| Refractive Index | n20/D 1.432(lit.) |
| MDL | MFCD00036138 |
3452-97-9 - Risk and Safety
| Risk Codes | R36 - Irritating to the eyes R51/53 - Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment. R52/53 - Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment. R22 - Harmful if swallowed R36/38 - Irritating to eyes and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S61 - Avoid release to the environment. Refer to special instructions / safety data sheets. S24/25 - Avoid contact with skin and eyes. |
| UN IDs | UN 3082 9/PG 3 |
| WGK Germany | 2 |
| HS Code | 29051990 |
| Hazard Class | 9 |
| Packing Group | III |
3452-97-9 - Reference Information
| FEMA | 3324 | 3,5,5-TRIMETHYL-1-HEXANOL |
| LogP | 3.7 at 25℃ |
| NIST chemical information | Information provided by: webbook.nist.gov (external link) |
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| toxicity | GRAS(FEMA). |
| usage limit | FEMA: baked goods and condiments, both 30.0 mg/kg. |
Last Update：2024-04-09 21:11:58
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