Ethyl 10-undecenoate (CAS 692-86-4) — formula C13H24O2, molecular weight 212.18 g/mol.
Documented applications: Uses: Used as a flavoring agent, [FDA] Permitted for use as an inert ingredient in non-food pesticide products, [EPA], Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 10-Undecenoic acid, ethyl ester: ACTIVE.
Ethyl 10-undecenoate is a chemical compound with CAS registry number 692-86-4 and molecular formula C13H24O2 (molecular weight 212.18 g/mol).
CAS number: 692-86-4
Its molecular formula C13H24O2 comprises 13 C, 24 H, 2 O atoms.
Also known as: Ethyl 10-undecenoate · ethyl undecylenate
The CAS registry number of Ethyl 10-undecenoate is 692-86-4.
Molecular formula C13H24O2, molecular weight 212.18 g/mol.
It is also registered under: Ethyl 10-undecenoate, ethyl undecylenate.
Recorded applications: Uses: Used as a flavoring agent, [FDA] Permitted for use as an inert ingredient in non-food pesticide products, [EPA], Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 10-Undecenoic acid, ethyl ester: ACTIVE.
Public-database records for Ethyl 10-undecenoate (CAS 692-86-4), reproduced here for independent cross-checking.
| GHS notification summary | 100% (236 / 236) |
|---|
This chemical does not meet GHS hazard criteria for 100% (236 of 236) of all reports.
Reported as not meeting GHS hazard criteria by 236 of 236 companies. For more detailed information, please visit ECHA C&L website.
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Green No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (236 / 236) |
| 沸点 | 258.00 to 259.00 °C. @ 760.00 mm Hg |
|---|---|
| 沸点 | 258-259 °C |
| 熔点 | -38 °C |
| 密度 | 0.877-0.882 |
| 折射率 | 1.436-1.442 |
| CAS Registry Number | 692-86-4 |
|---|---|
| PubChem CID | 12729 |
| 分子式 | C13H24O2 |
| 分子量 | 212.18 g/mol |
| IUPAC 名称 | ethyl undec-10-enoate |
| InChIKey | FXNFFCMITPHEIT-UHFFFAOYSA-N |
| UNII（FDA） | 7P1S77T8BF |
| ChEBI 编号 | CHEBI:171792 |
| FEMA 编号 | 2461 |
| JECFA 编号 | 343 |
ETHYL 10-UNDECENOATE; 692-86-4; Ethyl undec-10-enoate; Ethyl undecylenate; 10-Undecenoic acid, ethyl ester; Ethyl undecenoate; Ethyl 10-hendecenoate; Ethyl 10-undecylenate; 10-Undecenoic Acid Ethyl Ester; FEMA No. 2461; MFCD00009220; DTXSID4044828; Undecenoic acid, ethyl ester; 7P1S77T8BF; Ethyl 10-Undecenoate; Ethyl Undecenoate; EINECS 211-734-8
| 分子量 | 212.33 |
|---|---|
| XLogP3 | 4.6 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 11 |
| 精确质量 | 212.177630004 |
| 单同位素质量 | 212.177630004 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 15 |
| 形式电荷 | 0 |
Ethyl 10-undecenoate is identified by CAS 692-86-4, molecular formula C13H24O2 and molecular weight 212.18 g/mol. UNII 7P1S77T8BF; ChEBI 171792; InChIKey FXNFFCMITPHEIT-UHFFFAOYSA-N. 沸点: 258.00 to 259.00 °C. @ 760.00 mm Hg; 沸点: 258-259 °C; 熔点: -38 °C.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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