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amyl isobutyrate · CAS 2445-72-9 · C9H18O2. UNII 7UEX06WJZW.
| CAS Registry Number | 2445-72-9 |
|---|---|
| PubChem CID | 75554 |
| Molecular formula | C9H18O2 |
| IUPAC name | pentyl 2-methylpropanoate |
| UNII (FDA) | 7UEX06WJZW |
| Molecular Weight | 158.24 |
|---|---|
| XLogP3 | 3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 6 |
| Exact Mass | 158.130679813 |
| Monoisotopic Mass | 158.130679813 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Regulatory & Food Contact | EU Flavoring substances Flavoring Agents |
|---|---|
| GHS notification summary | 88.7% (125 / 141) |
| GHS notification summary | 88.7% (125 / 141) |
|---|---|
| Reported hazard statements | H226 (11.3%) |
This chemical does not meet GHS hazard criteria for 88.7% (125 of 141) of all reports.
H226 (11.3%): Flammable liquid and vapor [Warning Flammable liquids]
Amyl isobutyrate; Pentyl isobutyrate; Pentyl 2-methylpropanoate; 2445-72-9; Propanoic acid, 2-methyl-, pentyl ester; Isobutyric acid, pentyl ester; Pentyl 2-methylpropionate; 7UEX06WJZW; EINECS 219-494-6; AI3-06017; DTXSID5074341; N-PENTYL 2-METHYLPROPANOATE; 2-METHYLPROPIONIC ACID PENTYL ESTER; RefChem:557940; DTXCID9037082; 219-494-6
CAS 2445-72-9; molecular formula C9H18O2; molecular weight — g/mol.
Amyl isobutyrate, Pentyl isobutyrate, Pentyl 2-methylpropanoate, 2445-72-9, Propanoic acid, 2-methyl-, pentyl ester, Isobutyric acid, pentyl ester.
Documented regulatory listings: EU Flavoring substances; Flavoring Agents.
88.7% of GHS notifications report no hazard classification (125 of 141).
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.