3,5,5-Trimethyl-1-hexanol
ALDRICH/W332402 - ≥85%
Synonym: 3,5,5-trimethyl hexanol
CAS Number: 3452-97-9
Empirical Formula (Hill Notation): C9H20O
Molecular Weight: 144.25
EC Number: 222-376-7
MDL Number: MFCD00036138
Linear Formula: (CH3)3CCH2CH(CH3)CH2CH2OH
Product Type: Chemical
| application(s) | flavors and fragrances |
| assay | ≥85% |
| biological source | synthetic |
| bp | 193-194 °C (lit.) |
| density | 0.824 g/mL at 25 °C (lit.) |
| documentation | see Safety & Documentation for available documents |
| food allergen | no known allergens |
| InChI | 1S/C9H20O/c1-8(5-6-10)7-9 |
| InChI key | BODRLKRKPXBDBN-UHFFFAOYSA |
| organoleptic | green; floral; herbaceous |
| Quality Level | 300  |
| refractive index | n |
| SMILES string | CC(CCO)CC(C)(C)C |
| Disclaimer: | For R&D or non-EU Food use. Not for retail sale. |
| General description: | 3,5,5-Trimethyl-1-hexanol is a branched chain saturated alcohol that is commonly used as a fragrance ingredient. It occurs naturally in Lycii fructus. |
| Packaging: | 1 kg in glass bottle |
| Packaging: | 8, 20 kg in poly drum |
| Symbol |    GHS07,GHS08,GHS09 |
| Signal word | Warning |
| Hazard statements | H315 - H319 - H373 - H411 |
| Precautionary statements | P273 - P302 + P352 - P305 + P351 + P338 - P314 |
| Hazard Codes | Xi,N |
| Risk Statements | 36/38-51/53 |
| Safety Statements | 26-61 |
| RIDADR | UN3082 - class 9 - PG 3 - DOT NA1993 - Environmentally hazardous |
| WGK Germany | WGK 2 |
| Flash Point(F) | 176.0 °F - closed cup |
| Flash Point(C) | 80 °C - closed cup |
| Purity | ≥85% |
| bp | 193-194 °C (lit.) |
| Density | 0.824 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| FEMA Number | 3324 |
| UNSPSC | 12164502 |