己酸-1,5-二甲基-1-乙烯基-4-己烯酯(CAS 7779-23-9):分子式 C16H28O2、分子量 252.39。
| CAS号 | 7779-23-9 |
|---|---|
| 分子式 | C16H28O2 |
| 分子量 | 252.39 |
| 沸点 | 252.00 °C. @ 760.00 mm Hg |
| LogP | 5.2 |
己酸-1,5-二甲基-1-乙烯基-4-己烯酯 是一种化工化合物,登记 CAS 号为 7779-23-9,分子式 C16H28O2(分子量 252.39)。
登记 CAS 号:7779-23-9
其分子式 C16H28O2 由 16 个碳、28 个氢、2 个氧 组成。
别名/同义词:己酸-1,5-二甲基-1-乙烯基-4-己烯酯 · linalyl caproate · Linalyl hexanoate
己酸-1,5-二甲基-1-乙烯基-4-己烯酯 的 CAS 登记号为 7779-23-9。
分子式 C16H28O2,分子量 252.39。
别名/同义词:己酸-1,5-二甲基-1-乙烯基-4-己烯酯、linalyl caproate、Linalyl hexanoate。
己酸-1,5-二甲基-1-乙烯基-4-己烯酯(CAS 7779-23-9)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 7779-23-9 |
|---|---|
| PubChem CID | 564550 |
| Molecular formula | C16H28O2 |
| Molecular weight | 252.21 g/mol |
| IUPAC name | 3,7-dimethylocta-1,6-dien-3-yl hexanoate |
| InChIKey | ALKCLFLTXBBMMP-UHFFFAOYSA-N |
| UNII (FDA) | 70M593F8B8 |
| ChEBI ID | CHEBI:196060 |
| FEMA number | 2643 |
| JECFA number | 364 |
| Molecular Weight | 252.39 |
|---|---|
| XLogP3 | 5.2 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 10 |
| Exact Mass | 252.208930132 |
| Monoisotopic Mass | 252.208930132 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 18 |
| Boiling Point | 252.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 252 °C |
| Density | 0.886-0.892 (20 °C) |
| Refractive Index | 1.451-1.460 |
Linalyl hexanoate; Linalyl caproate; Linalyl hexoate; 7779-23-9; Linalyl capronate; 3,7-dimethylocta-1,6-dien-3-yl hexanoate; Hexanoic acid, 1-ethenyl-1,5-dimethyl-4-hexenyl ester; FEMA No. 2643; 3,7-Dimethyl-1,6-octadien-3-yl hexanoate; Hexanoic acid, 1,5-dimethyl-1-vinyl-4-hexenyl ester; 70M593F8B8; Hexanoic acid, 1-ethenyl-1,5-dimethyl-4-hexen-1-yl ester; DTXSID3052519; RefChem:153482; DTXCID1031092; 231-922-3
| Regulatory & Food Contact | 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 notification summary | 100% (235 / 235) |
| GHS notification summary | 100% (235 / 235) |
|---|
This chemical does not meet GHS hazard criteria for 100% (235 of 235) of all reports.
Reported as not meeting GHS hazard criteria by 235 of 235 companies. For more detailed information, please visit ECHA C&L website.
Linalyl hexanoate is identified by CAS 7779-23-9, molecular formula C16H28O2 and molecular weight 252.21 g/mol. UNII 70M593F8B8; ChEBI 196060; InChIKey ALKCLFLTXBBMMP-UHFFFAOYSA-N. Boiling Point: 252.00 °C. @ 760.00 mm Hg; Boiling Point: 252 °C; Density: 0.886-0.892 (20 °C).
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: linalyl caproate