Cis-3-hexenyl acetate synthetic (CAS 3681-71-8) — formula C8H14O2, molecular weight 142.20; category organic chemicals.
Documented applications: Fragrance, Fragrance Ingredients.
Cis-3-hexenyl acetate synthetic is a carbon-based organic compound with CAS registry number 3681-71-8 and molecular formula C8H14O2 (molecular weight 142.20), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 3681-71-8
Its molecular formula C8H14O2 comprises 8 C, 14 H, 2 O atoms.
Also known as: Cis-3-hexenyl acetate synthetic · cis-3-Hexenyl Acetate · Cis-3-hexenyl acetate natural · cis-3-Hexen-1-yl acetate (Leaf acetate)
Category: organic chemicals
The CAS registry number of Cis-3-hexenyl acetate synthetic is 3681-71-8.
Molecular formula C8H14O2, molecular weight 142.20.
It is also registered under: Cis-3-hexenyl acetate synthetic, cis-3-Hexenyl Acetate, Cis-3-hexenyl acetate natural, cis-3-Hexen-1-yl acetate (Leaf acetate).
Recorded applications: Fragrance, Fragrance Ingredients.
Category: Organic Chemicals.
Public-database records for Cis-3-hexenyl acetate synthetic (CAS 3681-71-8), reproduced here for independent cross-checking.
| GHS notification summary | 0.6% (11 / 1882) |
|---|---|
| Reported hazard statements | H226 (99.4%) |
This chemical does not meet GHS hazard criteria for 0.6% (11 of 1882) of reports.
H226 (99.4%): Flammable liquid and vapor [Warning Flammable liquids]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Banana, Candy, Floral, Green No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 0.6% (11 / 1882) |
| 沸点 | 75.00 to 76.00 °C. @ 23.00 mm Hg |
|---|---|
| 沸点 | 198 °C |
| 溶解度 | 0.9 g/L @ 20 °C (exp) |
| 密度 | 0.896-0.901 |
| 折射率 | 1.425-1.429 |
| CAS Registry Number | 3681-71-8 |
|---|---|
| PubChem CID | 5363388 |
| 分子式 | C8H14O2 |
| 分子量 | 142.10 g/mol |
| IUPAC 名称 | [(Z)-hex-3-enyl] acetate |
| InChIKey | NPFVOOAXDOBMCE-PLNGDYQASA-N |
| UNII（FDA） | 6INA6GC5I6 |
| ChEBI 编号 | CHEBI:61316 |
| FEMA 编号 | 3171 |
| JECFA 编号 | 134 |
cis-3-Hexenyl acetate; 3681-71-8; [(Z)-hex-3-enyl] acetate; 3-Hexenylacetate; cis-3-Hexenyl ethanoate; FEMA No. 3171; 6INA6GC5I6; ((Z)-hex-3-enyl) acetate; RefChem:502210; (Z)-3-HEXENYL ACETATE; (3Z)-3-Hexenyl acetate; (Z)-Hex-3-enyl acetate; cis-3-Hexen-1-yl acetate; (3Z)-hex-3-en-1-yl acetate; 3-Hexen-1-ol, acetate, (Z)-; cis-3-Hexenol acetate
| 分子量 | 142.20 |
|---|---|
| XLogP3 | 1.9 |
| 氢键供体数 | 0 |
| 氢键受体数 | 2 |
| 可旋转键数 | 5 |
| 精确质量 | 142.099379685 |
| 单同位素质量 | 142.099379685 |
| 拓扑极性表面积 | 26.3 |
| 重原子数 | 10 |
| 形式电荷 | 0 |
cis-3-Hexen-1-yl acetate (Leaf acetate) is identified by CAS 3681-71-8, molecular formula C8H14O2 and molecular weight 142.10 g/mol. UNII 6INA6GC5I6; ChEBI 61316; InChIKey NPFVOOAXDOBMCE-PLNGDYQASA-N. 沸点: 75.00 to 76.00 °C. @ 23.00 mm Hg; 沸点: 198 °C; 溶解度: 0.9 g/L @ 20 °C (exp).
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.