Isobutyl formate
ALDRICH/W219703 - ≥95%, FG
CAS Number: 542-55-2
Empirical Formula (Hill Notation): C5H10O2
Molecular Weight: 102.13
EC Number: 208-818-1
MDL Number: MFCD00003293
Linear Formula: HCO2CH2CH(CH3)2
Product Type: Chemical
agency | meets purity specifications of JECFA |
application(s) | flavors and fragrances |
assay | ≥95% |
autoignition temp. | 608 °F |
biological source | synthetic |
bp | 98.4 °C (lit.) |
density | 0.885 g/mL at 25 °C (lit.) |
documentation | see Safety & Documentation for available documents |
expl. lim. | 8.9 % |
food allergen | no known allergens |
grade | FG |
Halal | |
Kosher | |
InChI | 1S/C5H10O2/c1-5(2)3-7-4-6 |
InChI key | AVMSWPWPYJVYKY-UHFFFAOYSA |
organoleptic | fruity; ethereal; sweet |
Quality Level | 400 |
refractive index | n |
reg. compliance | EU Regulation 1334/2008 & 178/2002 |
FDA 21 CFR 117 | |
FDA 21 CFR 172.515 | |
SMILES string | CC(C)COC=O |
vapor density | 3.52 (vs air) |
Biochem/physiol Actions: | Taste at 10 ppm |
Other Notes: | Natural occurrence: Apple, beer, grape brandy, pineapple, rum and vinegar. |
Symbol | GHS02,GHS07 |
Signal word | Danger |
Hazard statements | H225 - H319 - H335 |
Precautionary statements | P210 - P305 + P351 + P338 |
Hazard Codes | F,Xi |
Risk Statements | 11-36/37 |
Safety Statements | 9-16-24-33 |
RIDADR | UN 2393 3 / PGII |
WGK Germany | WGK 2 |
Flash Point(F) | 50.0 °F - closed cup |
Flash Point(C) | 10 °C - closed cup |
Purity | ≥95% |
bp | 98.4 °C (lit.) |
Density | 0.885 g/mL at 25 °C (lit.) |
Refractive Index | n |
FEMA Number | 2197 |
UNSPSC | 12164502 |