Ethyl isobutyrate
ALDRICH/W242810 - natural, ≥98%, FCC, FG
Synonym: 2-methyl propionic acid ethyl ester; Ethyl 2-methylpropanoate; Ethyl isobutanoate
CAS Number: 97-62-1
Empirical Formula (Hill Notation): C6H12O2
Molecular Weight: 116.16
EC Number: 202-595-4
MDL Number: MFCD00009165
Linear Formula: (CH3)2CHCOOC2H5
Product Type: Chemical
12 Principles of Green Chemistry: Principle 3—Less Hazardous Chemical Syntheses. This product manufacturing process was designed with lesser toxicity to human health and the environment.
12 Principles of Green Chemistry: Principle 7—A raw material or feedstock should be renewable rather than depleting whenever technically and economically practicable.
| agency | follows IFRA guidelines |
| meets purity specifications of JECFA | |
| application(s) | flavors and fragrances |
| assay | ≥98% |
| bp | 112-113 °C (lit.) |
| density | 0.865 g/mL at 25 °C (lit.) |
| documentation | see Safety & Documentation for available documents |
| food allergen | no known allergens |
| fragrance allergen | no known allergens |
| grade | FG |
| Fragrance grade | |
| Halal | |
| Kosher | |
| natural | |
| greener alternative category | Aligned  |
| greener alternative product characteristics | Less Hazardous Chemical Syntheses Use of Renewable Feedstocks Learn more about the Principles of Green Chemistry . |
| InChI | 1S/C6H12O2/c1-4-8-6(7)5(2 |
| InChI key | WDAXFOBOLVPGLV-UHFFFAOYSA |
| organoleptic | fruity; ethereal; sweet |
| Quality Level | 300 |
| 400 |
|
| refractive index | n |
| reg. compliance | EU Regulation 1223/2009 |
| EU Regulation 1334/2008 & 178/2002 | |
| FCC | |
| FDA 21 CFR 117 | |
| SMILES string | CCOC(=O)C(C)C |
| sustainability | Greener Alternative Product |
| vapor density | 4.01 (vs air) |
| vapor pressure | 40 mmHg ( 33.8 °C) |
| Packaging: | 1 kg in glass bottle |
| Packaging: | 100 g in glass bottle |
| Packaging: | 25 g in poly bottle |
| Symbol |  GHS02 |
| Signal word | Danger |
| Hazard statements | H225 |
| Precautionary statements | P210 - P370 + P378 - P403 + P235 |
| Hazard Codes | F,Xi |
| Risk Statements | 11-36/37/38 |
| Safety Statements | 16-26-36 |
| RIDADR | UN 2385 3 / PGII |
| WGK Germany | WGK 2 |
| Flash Point(F) | 68.0 °F - closed cup |
| Flash Point(C) | 20 °C - closed cup |
| Purity | ≥98% |
| bp | 112-113 °C (lit.) |
| Density | 0.865 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| FEMA Number | 2428 |
| UNSPSC | 12164502 |