FEMA 3221 (CAS 6290-37-5) — formula C14H20O2, molecular weight 220.31; category organic chemicals.
| CAS Number | 6290-37-5 |
|---|---|
| Molecular Formula | C14H20O2 |
| Molecular Weight | 220.31 |
| Boiling Point | 263 °C |
| LogP | 4.2 |
| Applications | Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Hexanoic acid, 2-phenylethyl ester: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Hexanoic acid, 2-phenylethyl ester: ACTIVE.
FEMA 3221 is a carbon-based organic compound with CAS registry number 6290-37-5 and molecular formula C14H20O2 (molecular weight 220.31), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6290-37-5
Its molecular formula C14H20O2 comprises 14 C, 20 H, 2 O atoms.
Also known as: FEMA 3221 · 己酸苯乙酯
Category: organic chemicals
The CAS registry number of FEMA 3221 is 6290-37-5.
Molecular formula C14H20O2, molecular weight 220.31.
It is also registered under: FEMA 3221, 己酸苯乙酯.
Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: Hexanoic acid, 2-phenylethyl ester: ACTIVE.
Category: Organic Chemicals.
Independent reference data for FEMA 3221 (CAS 6290-37-5), compiled from public chemistry databases.
| CAS 号 | 6290-37-5 |
|---|---|
| PubChem CID | 61384 |
| 分子式 | C14H20O2 |
| IUPAC 名称 | 2-phenylethyl hexanoate |
| UNII（FDA） | X7R57M68KR |
| FEMA 编号 | 3221 |
| JECFA 编号 | 995 |
| Molecular Weight | 220.31 |
|---|---|
| XLogP3 | 4.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 220.146329876 |
| Monoisotopic Mass | 220.146329876 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 16 |
| Boiling Point | 263 °C |
|---|---|
| Density | 0.969-0.980 |
| Refractive Index | 1.480-1.488 |
2-Phenylethyl hexanoate; 6290-37-5; PHENETHYL HEXANOATE; 2-Phenethyl hexanoate; Hexanoic acid, 2-phenylethyl ester; Phenylethyl caproate; Hexanoic acid, phenethyl ester; 2-Phenylethyl caproate; Benzylcarbinyl caproate; Phenylethyl hexanoate; Benzylcarbinyl hexanoate; FEMA No. 3221; DTXSID5047584; NSC 6651; X7R57M68KR; NSC-6651
| 法规与食品接触 | 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 通报统计 | 100% (91 / 91) |
| GHS 通报统计 | 100% (91 / 91) |
|---|
己酸苯乙酯 · CAS 6290-37-5 · C14H20O2. UNII X7R57M68KR. Boiling Point: 263 °C; Density: 0.969-0.980; Refractive Index: 1.480-1.488.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 己酸苯乙酯