amyl isobutyrate (CAS 2445-72-9) — formula C9H18O2, molecular weight 158.24; category organic chemicals.
| CAS Number | 2445-72-9 |
|---|---|
| Molecular Formula | C9H18O2 |
| Molecular Weight | 158.24 |
| LogP | 3 |
| Applications | Use Classification: Fragrance Ingredients, General Manufacturing Information: Propanoic acid, 2-methyl-, pentyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, General Manufacturing Information: Propanoic acid, 2-methyl-, pentyl ester: ACTIVE.
amyl isobutyrate is a carbon-based organic compound with CAS registry number 2445-72-9 and molecular formula C9H18O2 (molecular weight 158.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 2445-72-9
Its molecular formula C9H18O2 comprises 9 C, 18 H, 2 O atoms.
Also known as: amyl isobutyrate · 异丁酸戊酯
Category: organic chemicals
The CAS registry number of amyl isobutyrate is 2445-72-9.
Molecular formula C9H18O2, molecular weight 158.24.
It is also registered under: amyl isobutyrate, 异丁酸戊酯.
Recorded applications: Use Classification: Fragrance Ingredients, General Manufacturing Information: Propanoic acid, 2-methyl-, pentyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for amyl isobutyrate (CAS 2445-72-9), compiled from public chemistry databases.
| 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 |
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
| 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 · CAS 2445-72-9 · C9H18O2. UNII 7UEX06WJZW.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 异丁酸戊酯