丁酸橙花酯(CAS 999-40-6):分子式 C14H24O2、分子量 224.34。
| CAS号 | 999-40-6 |
|---|---|
| 分子式 | C14H24O2 |
| 分子量 | 224.34 |
| 沸点 | 239.00 to 240.00 °C. @ 760.00 mm Hg |
| LogP | 4.3 |
丁酸橙花酯 是一种化工化合物,登记 CAS 号为 999-40-6,分子式 C14H24O2(分子量 224.34)。
登记 CAS 号:999-40-6
其分子式 C14H24O2 由 14 个碳、24 个氢、2 个氧 组成。
别名/同义词:丁酸橙花酯 · NERYL BUTYRATE
丁酸橙花酯 的 CAS 登记号为 999-40-6。
分子式 C14H24O2,分子量 224.34。
别名/同义词:丁酸橙花酯、NERYL BUTYRATE。
丁酸橙花酯(CAS 999-40-6)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 999-40-6 |
|---|---|
| PubChem CID | 5352162 |
| Molecular formula | C14H24O2 |
| IUPAC name | [(2Z)-3,7-dimethylocta-2,6-dienyl] butanoate |
| UNII (FDA) | 83580OVF8U |
| FEMA number | 2774 |
| JECFA number | 67 |
| Molecular Weight | 224.34 |
|---|---|
| XLogP3 | 4.3 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 224.177630004 |
| Monoisotopic Mass | 224.177630004 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 16 |
| Boiling Point | 239.00 to 240.00 °C. @ 760.00 mm Hg |
|---|---|
| Boiling Point | 239 - 240 °C |
| Density | 0.898-0.910 |
| Refractive Index | 1.4539-1.4650 |
Neryl butyrate; 999-40-6; Neryl butanoate; Nonyl n-butyrate; [(2Z)-3,7-dimethylocta-2,6-dienyl] butanoate; FEMA No. 2774; Neryl butyrate (natural); UNII-83580OVF8U; Butanoic acid, (2Z)-3,7-dimethyl-2,6-octadien-1-yl ester; 83580OVF8U; EINECS 213-660-1; NERYL BUTYRATE [FHFI]; 3,7-Dimethyl-2,6-octadienyl butanoate, cis-; 3,7-Dimethyl-2,6-octadienyl butyrate, (Z)-; DTXSID60883634; 3,7-Dimethyl-2,6-octadienyl butanoate, (Z)-
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Floral No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (90 / 90) |
| GHS notification summary | 100% (90 / 90) |
|---|
This chemical does not meet GHS hazard criteria for 100% (90 of 90) of all reports.
Reported as not meeting GHS hazard criteria by 90 of 90 companies. For more detailed information, please visit ECHA C&L website.
NERYL BUTYRATE · CAS 999-40-6 · C14H24O2. UNII 83580OVF8U. Boiling Point: 239.00 to 240.00 °C. @ 760.00 mm Hg; Boiling Point: 239 - 240 °C; Density: 0.898-0.910.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: NERYL BUTYRATE