Butyl 10-undecylenate (CAS 109-42-2) — formula C15H28O2, molecular weight 240.21 g/mol.
Butyl 10-undecylenate is a chemical compound with CAS registry number 109-42-2 and molecular formula C15H28O2 (molecular weight 240.21 g/mol).
CAS number: 109-42-2
Its molecular formula C15H28O2 comprises 15 C, 28 H, 2 O atoms.
Also known as: Butyl 10-undecylenate · BUTYL UNDECYLENATE
The CAS registry number of Butyl 10-undecylenate is 109-42-2.
Molecular formula C15H28O2, molecular weight 240.21 g/mol.
It is also registered under: Butyl 10-undecylenate, BUTYL UNDECYLENATE.
Public-database records for Butyl 10-undecylenate (CAS 109-42-2), reproduced here for independent cross-checking.
| GHS 通报统计 | 1.4% (20 / 1402) |
|---|---|
| 已通报的危害声明 | H315 (98.6%), H319 (92.5%) |
| 法规与食品接触 | 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 通报统计 | 1.4% (20 / 1402) |
| 沸点 | 249.00 to 254.00 °C. @ 756.00 mm Hg |
|---|---|
| 沸点 | 125-128 °C |
| 密度 | 0.872-0.878 (20 °C) |
| 折射率 | 1.439-1.445 |
| CAS 号 | 109-42-2 |
|---|---|
| PubChem CID | 61027 |
| 分子式 | C15H28O2 |
| 分子量 | 240.21 g/mol |
| IUPAC 名称 | butyl undec-10-enoate |
| InChIKey | GRAORJFMGCQWRN-UHFFFAOYSA-N |
| UNII（FDA） | O3OKK2UWV6 |
| ChEBI 编号 | CHEBI:169713 |
| FEMA 编号 | 2216 |
| JECFA 编号 | 344 |
Butyl undec-10-enoate; Butyl 10-undecenoate; Butyl undecylenate; 10-UNDECENOIC ACID, BUTYL ESTER; Butyl 10-undecylenate; FEMA No. 2216; DTXSID4047624; n-Butyl 10-undecenoate; UNII-O3OKK2UWV6; O3OKK2UWV6; NSC 2395; EINECS 203-670-4; BRN 1776569; AI3-05920; NSC-2395; DTXCID2027624
| 分子量 | 240.38 |
|---|---|
| XLogP3 | 5.5 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 13 |
| 精确质量 | 240.208930132 |
| 单同位素质量 | 240.208930132 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 17 |
| 形式电荷 | 0 |
10-十一烯酸丁酯 的 CAS 号为 109-42-2，分子式 C15H28O2，分子量 240.21 g/mol。 UNII O3OKK2UWV6; ChEBI 169713; InChIKey GRAORJFMGCQWRN-UHFFFAOYSA-N. 沸点: 249.00 to 254.00 °C. @ 756.00 mm Hg; 沸点: 125-128 °C; 密度: 0.872-0.878 (20 °C).
Source: PubChem / Wikidata; the batch COA governs where values differ.
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