3,7-二甲基-6-辛烯-1-戊酸酯(CAS 7540-53-6):分子式 C15H28O2、分子量 240.38。
| CAS号 | 7540-53-6 |
|---|---|
| 分子式 | C15H28O2 |
| 分子量 | 240.38 |
| 沸点 | 237.00 to 240.00 °C. @ 760.00 mm Hg |
| LogP | 5.1 |
3,7-二甲基-6-辛烯-1-戊酸酯 是一种化工化合物,登记 CAS 号为 7540-53-6,分子式 C15H28O2(分子量 240.38)。
登记 CAS 号:7540-53-6
其分子式 C15H28O2 由 15 个碳、28 个氢、2 个氧 组成。
别名/同义词:3,7-二甲基-6-辛烯-1-戊酸酯 · 3,7-DIMETHYL-6-OCTEN-1-YL VALERATE · CITRONELLYL VALERATE · 3,7-dimethyloct-6-enyl valerate
3,7-二甲基-6-辛烯-1-戊酸酯 的 CAS 登记号为 7540-53-6。
分子式 C15H28O2,分子量 240.38。
别名/同义词:3,7-二甲基-6-辛烯-1-戊酸酯、3,7-DIMETHYL-6-OCTEN-1-YL VALERATE、CITRONELLYL VALERATE、3,7-dimethyloct-6-enyl valerate。
3,7-二甲基-6-辛烯-1-戊酸酯(CAS 7540-53-6)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 7540-53-6 |
|---|---|
| PubChem CID | 61416 |
| Molecular formula | C15H28O2 |
| IUPAC name | 3,7-dimethyloct-6-enyl pentanoate |
| UNII (FDA) | 43TPH8V20B |
| FEMA number | 2317 |
| JECFA number | 69 |
| Molecular Weight | 240.38 |
|---|---|
| XLogP3 | 5.1 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 10 |
| Exact Mass | 240.208930132 |
| Monoisotopic Mass | 240.208930132 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 17 |
| Boiling Point | 237.00 to 240.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 237 °C |
| Density | 0.890 (15.5 °C) |
| Refractive Index | 1.4435 |
CITRONELLYL VALERATE; 7540-53-6; Citronellyl pentanoate; 3,7-dimethyloct-6-enyl pentanoate; Pentanoic acid, 3,7-dimethyl-6-octenyl ester; 3,7-Dimethyloct-6-enyl valerate; Pentanoic acid, 3,7-dimethyl-6-octen-1-yl ester; FEMA No. 2317; 3,7-dimethyloct-6-en-1-yl pentanoate; 43TPH8V20B; DTXSID00864088; RefChem:126600; DTXCID90812639; 231-416-2; 3,7-Dimethyl-6-octen-1-yl valerate; 3,7-Dimethyl-6-octen-1-yl pentanoate
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Herb, Honey, Rose, Warm No safety concern at current levels of intake when used as a flavouring agent |
|---|
| Reported hazard statements | H315 (100%), H319 (100%), H335 (100%), H413 (30.5%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
3,7-dimethyloct-6-enyl valerate · CAS 7540-53-6 · C15H28O2. UNII 43TPH8V20B. Boiling Point: 237.00 to 240.00 °C. @ 760.00 mm Hg; Boiling Point: 237 °C; Density: 0.890 (15.5 °C).
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 3,7-DIMETHYL-6-OCTEN-1-YL VALERATE