piperonyl isobutyrate (CAS 5461-08-5) — formula C12H14O4, molecular weight 222.24; category organic chemicals.
piperonyl isobutyrate (CAS 5461-08-5) is a chemical raw material in the organic chemicals category. Its molecular formula C12H14O4 comprises 12 C, 14 H, 4 O atoms. Its molecular weight is about 222.24. Reported physicochemical data: LogP about 2.7. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 5461-08-5 |
|---|---|
| Molecular Formula | C12H14O4 |
| Molecular Weight | 222.24 |
| LogP | 2.7 |
| Applications | flavoring agent, Flavouring Agent, Propanoic acid, 2-methyl, 3-benzodioxol-5-ylmethyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: flavoring agent, Flavouring Agent, Propanoic acid, 2-methyl, 3-benzodioxol-5-ylmethyl ester: ACTIVE.
piperonyl isobutyrate is a carbon-based organic compound with CAS registry number 5461-08-5 and molecular formula C12H14O4 (molecular weight 222.24), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5461-08-5
Its molecular formula C12H14O4 comprises 12 C, 14 H, 4 O atoms.
Also known as: piperonyl isobutyrate · 胡椒基异丁酸酯
Category: organic chemicals
The CAS registry number of piperonyl isobutyrate is 5461-08-5.
Molecular formula C12H14O4, molecular weight 222.24.
It is also registered under: piperonyl isobutyrate, 胡椒基异丁酸酯.
Recorded applications: flavoring agent, Flavouring Agent, Propanoic acid, 2-methyl, 3-benzodioxol-5-ylmethyl ester: ACTIVE.
Category: Organic Chemicals.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for piperonyl isobutyrate (CAS 5461-08-5), compiled from public chemistry databases.
| CAS Registry Number | 5461-08-5 |
|---|---|
| PubChem CID | 62580 |
| Molecular formula | C12H14O4 |
| IUPAC name | 1,3-benzodioxol-5-ylmethyl 2-methylpropanoate |
| UNII (FDA) | Y8HBR1ACYA |
| FEMA number | 2913 |
| Molecular Weight | 222.24 |
|---|---|
| XLogP3 | 2.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 4 |
| Exact Mass | 222.08920892 |
| Monoisotopic Mass | 222.08920892 |
| Topological Polar Surface Area | 44.8 |
| Heavy Atom Count | 16 |
Piperonyl isobutyrate; 5461-08-5; Piperonyl 2-methylpropanoate; Heliotropyl 2-methylpropanoate; Y8HBR1ACYA; FEMA No. 2913; NSC-23947; PROPANOIC ACID, 2-METHYL-, 1,3-BENZODIOXOL-5-YLMETHYL ESTER; DTXSID8063917; 2H-1,3-benzodioxol-5-ylmethyl 2-methylpropanoate; RefChem:174463; DTXCID1041762; 1,3-benzodioxole-5-methanol isobutyrate; 226-745-3; 229-993-0; 1,3-Benzodioxol-5-ylmethyl 2-methylpropanoate
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 0.8% (11 / 1399) |
| GHS notification summary | 0.8% (11 / 1399) |
|---|---|
| Reported hazard statements | H302 (99.2%) |
This chemical does not meet GHS hazard criteria for 0.8% (11 of 1399) of reports.
H302 (99.2%): Harmful if swallowed [Warning Acute toxicity, oral]
piperonyl isobutyrate · CAS 5461-08-5 · C12H14O4. UNII Y8HBR1ACYA.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 胡椒基异丁酸酯