2-phenylethyl caprylate (CAS 5457-70-5) — formula C16H24O2, molecular weight 248.36; category organic chemicals.
2-phenylethyl caprylate (CAS 5457-70-5) is a organic chemicals. Its molecular formula C16H24O2 comprises 16 C, 24 H, 2 O atoms. Its molecular weight is about 248.36. Reported physicochemical data: boiling point around 295.00 to 296.00 °C. @ 760.00 mm Hg, LogP about 5.1. Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries. Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials. 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 | 5457-70-5 |
|---|---|
| Molecular Formula | C16H24O2 |
| Molecular Weight | 248.36 |
| Boiling Point | 295.00 to 296.00 °C. @ 760.00 mm Hg |
| LogP | 5.1 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering |
| Category | Organic Chemicals |
Documented applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
2-phenylethyl caprylate is a carbon-based organic compound with CAS registry number 5457-70-5 and molecular formula C16H24O2 (molecular weight 248.36), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5457-70-5
Its molecular formula C16H24O2 comprises 16 C, 24 H, 2 O atoms.
Also known as: 2-phenylethyl caprylate · 辛酸苯乙酯 · Phenethyl octanoate
Category: organic chemicals
The CAS registry number of 2-phenylethyl caprylate is 5457-70-5.
Molecular formula C16H24O2, molecular weight 248.36.
It is also registered under: 2-phenylethyl caprylate, 辛酸苯乙酯, Phenethyl octanoate.
Recorded applications: agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
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 2-phenylethyl caprylate (CAS 5457-70-5), compiled from public chemistry databases.
| CAS Registry Number | 5457-70-5 |
|---|---|
| PubChem CID | 229888 |
| Molecular formula | C16H24O2 |
| Molecular weight | 248.18 g/mol |
| IUPAC name | 2-phenylethyl octanoate |
| InChIKey | ASETYIALRXDVDF-UHFFFAOYSA-N |
| UNII (FDA) | 89J4RI53EZ |
| ChEBI ID | CHEBI:171699 |
| FEMA number | 3222 |
| JECFA number | 996 |
| Molecular Weight | 248.36 |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 10 |
| Exact Mass | 248.177630004 |
| Monoisotopic Mass | 248.177630004 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 18 |
| Boiling Point | 295.00 to 296.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 295.5 °C; 143.5 °C (1.5 mm Hg) |
| Density | 0.973-0.977 (20 °C) |
| Refractive Index | 1.479-1.486 |
Phenethyl octanoate; 2-Phenylethyl octanoate; Phenylethyl octanoate; 2-Phenethyl octanoate; Octanoic acid, phenethyl ester; Octanoic acid, 2-phenylethyl ester; Phenethyl caprylate; Phenylethyl caprylate; Phenylethyl n-octanoate; FEMA No. 3222; UNII-89J4RI53EZ; 89J4RI53EZ; EINECS 226-718-6; NSC 23950; NSC-23950; 2-Phenylethyl-n-octanoate
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: 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 | 100% (94 / 94) |
| GHS notification summary | 100% (94 / 94) |
|---|
This chemical does not meet GHS hazard criteria for 100% (94 of 94) of all reports.
Reported as not meeting GHS hazard criteria by 94 of 94 companies. For more detailed information, please visit ECHA C&L website.
Phenethyl octanoate is identified by CAS 5457-70-5, molecular formula C16H24O2 and molecular weight 248.18 g/mol. UNII 89J4RI53EZ; ChEBI 171699; InChIKey ASETYIALRXDVDF-UHFFFAOYSA-N. Boiling Point: 295.00 to 296.00 °C. @ 760.00 mm Hg; Boiling Point: 295.5 °C; 143.5 °C (1.5 mm Hg); Density: 0.973-0.977 (20 °C).
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 辛酸苯乙酯