Isobutyl phenylacetate
ALDRICH/W221055 - natural, ≥98%, FG
Synonym: Phenyl acetic acid isobutyl ester
CAS Number: 102-13-6
Empirical Formula (Hill Notation): C12H16O2
Molecular Weight: 192.25
MDL Number: MFCD00026482
Linear Formula: C6H5CH2CO2CH2CH(CH3)2
Product Type: Chemical
agency | follows IFRA guidelines |
application(s) | flavors and fragrances |
assay | ≥98% |
biological source | botanical |
bp | 253 °C (lit.) |
density | 0.986 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 | |
InChI | 1S/C12H16O2/c1-10(2)9-14- |
InChI key | RJASFPFZACBKBE-UHFFFAOYSA |
organoleptic | honey; floral; sweet |
Quality Level | 400 ![]() |
refractive index | n |
reg. compliance | EU Regulation 1223/2009 |
EU Regulation 1334/2008 & 872/2012 | |
FDA 21 CFR 117 | |
SMILES string | CC(C)COC(=O)Cc1ccccc1 |
Symbol | ![]() |
Signal word | Warning |
Hazard statements | H315 - H319 - H335 |
Precautionary statements | P305 + P351 + P338 |
RIDADR | NONH for all modes of transport |
WGK Germany | WGK 2 |
Flash Point(F) | 235.4 °F - closed cup |
Flash Point(C) | 113 °C - closed cup |
Purity | ≥98% |
bp | 253 °C (lit.) |
Density | 0.986 g/mL at 25 °C (lit.) |
Refractive Index | n |
FEMA Number | 2210 |
UNSPSC | 12164502 |