caprylic acid N-butyl ester (CAS 589-75-3) — formula C12H24O2, molecular weight 200.32; category organic chemicals.
| CAS Number | 589-75-3 |
|---|---|
| Molecular Formula | C12H24O2 |
| Molecular Weight | 200.32 |
| LogP | 4.4 |
| Applications | Use Classification: Fragrance Ingredients, General Manufacturing Information: Octanoic acid, butyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, General Manufacturing Information: Octanoic acid, butyl ester: ACTIVE.
caprylic acid N-butyl ester is a carbon-based organic compound with CAS registry number 589-75-3 and molecular formula C12H24O2 (molecular weight 200.32), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 589-75-3
Its molecular formula C12H24O2 comprises 12 C, 24 H, 2 O atoms.
Also known as: caprylic acid N-butyl ester · 辛酸正丁酯
Category: organic chemicals
The CAS registry number of caprylic acid N-butyl ester is 589-75-3.
Molecular formula C12H24O2, molecular weight 200.32.
It is also registered under: caprylic acid N-butyl ester, 辛酸正丁酯.
Recorded applications: Use Classification: Fragrance Ingredients, General Manufacturing Information: Octanoic acid, butyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for caprylic acid N-butyl ester (CAS 589-75-3), compiled from public chemistry databases.
| CAS Registry Number | 589-75-3 |
|---|---|
| PubChem CID | 11517 |
| Molecular formula | C12H24O2 |
| IUPAC name | butyl octanoate |
| UNII (FDA) | 4I64Y9N2WO |
| Molecular Weight | 200.32 |
|---|---|
| XLogP3 | 4.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 10 |
| Exact Mass | 200.177630004 |
| Monoisotopic Mass | 200.177630004 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 14 |
BUTYL OCTANOATE; Butyl caprylate; 589-75-3; n-Butylcaprylate; n-Butyl octanoate; Octanoic acid, butyl ester; NSC-23740; 4I64Y9N2WO; DTXSID0060432; CHEBI:87380; RefChem:122284; DTXCID1042495; 209-659-0; EBK588Q27T; Butyl n-Octanoate; Octanoic acid butyl ester
| Regulatory & Food Contact | EU Flavoring substances Flavoring Agents |
|---|---|
| GHS notification summary | 99.3% (137 / 138) |
| GHS notification summary | 99.3% (137 / 138) |
|---|
This chemical does not meet GHS hazard criteria for 99.3% (137 of 138) of all reports.
Reported as not meeting GHS hazard criteria by 137 of 138 companies (only 0.7% companies provided GHS information). For more detailed information, please visit ECHA C&L website.
caprylic acid N-butyl ester · CAS 589-75-3 · C12H24O2. UNII 4I64Y9N2WO.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 辛酸正丁酯