Cis-3-hexenyl lactate natural (CAS 61931-81-5) — formula C9H16O3, molecular weight 172.22; category organic chemicals.
Cis-3-hexenyl lactate natural is a carbon-based organic compound with CAS registry number 61931-81-5 and molecular formula C9H16O3 (molecular weight 172.22), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 61931-81-5
Its molecular formula C9H16O3 comprises 9 C, 16 H, 3 O atoms.
Also known as: Cis-3-hexenyl lactate natural · cis-3-hexenyl lactate · Cis-3-hexenyl lactate synthetic
Category: organic chemicals
The CAS registry number of Cis-3-hexenyl lactate natural is 61931-81-5.
Molecular formula C9H16O3, molecular weight 172.22.
It is also registered under: Cis-3-hexenyl lactate natural, cis-3-hexenyl lactate, Cis-3-hexenyl lactate synthetic.
Category: Organic Chemicals.
Public-database records for Cis-3-hexenyl lactate natural (CAS 61931-81-5), reproduced here for independent cross-checking.
| GHS 通报统计 | 79.4% (166 / 209) |
|---|---|
| 已通报的危害声明 | H315 (20.6%), H319 (20.6%), H335 (20.1%) |
| 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 Green No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS 通报统计 | 79.4% (166 / 209) |
| 沸点 | 71.00 °C. @ 0.70 mm Hg |
|---|---|
| 沸点 | 96 °C (7 mm Hg) |
| 密度 | 0.968-0.984 |
| 折射率 | 1.441-1.451 |
| CAS 号 | 61931-81-5 |
|---|---|
| PubChem CID | 5364231 |
| 分子式 | C9H16O3 |
| 分子量 | 172.11 g/mol |
| IUPAC 名称 | [(Z)-hex-3-enyl] 2-hydroxypropanoate |
| InChIKey | NNLLMULULOBXBY-PLNGDYQASA-N |
| UNII（FDA） | 55ET6N4SAG |
| ChEBI 编号 | CHEBI:171942 |
| FEMA 编号 | 3690 |
| JECFA 编号 | 934 |
cis-3-Hexenyl lactate; 61931-81-5; (Z)-3-Hexenyl lactate; 3-Hexenyl lactate, (Z)-; (Z)-Hex-3-enyl lactate; FEMA No. 3690; 3-Hexenyl lactate, cis-; (3Z)-hex-3-en-1-yl 2-hydroxypropanoate; 3-Hexenyl lactate, (3Z)-; 3-Hexenyl 2-hydroxypropanoate, cis-; Propanoic acid, 2-hydroxy-, (3Z)-3-hexenyl ester; cis-3-Hexenyl lactate (natural); Propanoic acid, 2-hydroxy-, 3-hexenyl ester, (Z)-; EINECS 263-337-4; 55ET6N4SAG; Propanoic acid, 2-hydroxy-, (3Z)-3-hexen-1-yl ester
| 分子量 | 172.22 |
|---|---|
| XLogP3 | 1.6 |
| 氢键供体数 | 1 |
| 氢键受体数 | 3 |
| 可旋转键数 | 6 |
| 精确质量 | 172.109944368 |
| 单同位素质量 | 172.109944368 |
| 拓扑极性表面积 | 46.5 |
| 重原子数 | 12 |
| 形式电荷 | 0 |
乳酸叶醇酯 的 CAS 号为 61931-81-5，分子式 C9H16O3，分子量 172.11 g/mol。 UNII 55ET6N4SAG; ChEBI 171942; InChIKey NNLLMULULOBXBY-PLNGDYQASA-N. 沸点: 71.00 °C. @ 0.70 mm Hg; 沸点: 96 °C (7 mm Hg); 密度: 0.968-0.984.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.