异戊酸橙花酯（CAS 3915-83-1）：分子式 C15H26O2、分子量 238.37。
| CAS号 | 3915-83-1 |
|---|---|
| 分子式 | C15H26O2 |
| 分子量 | 238.37 |
| 沸点 | 145.00 °C. @ 15.00 mm Hg |
| LogP | 4.7 |
| 应用领域 | Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: Butanoic acid、3-methyl-、(2Z)-3、7-dimethyl-2、6-octadien-1-yl ester: ACTIVE |
登记用途：Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: Butanoic acid、3-methyl-、(2Z)-3、7-dimethyl-2、6-octadien-1-yl ester: ACTIVE。
异戊酸橙花酯 是一种化工化合物，登记 CAS 号为 3915-83-1，分子式 C15H26O2（分子量 238.37）。
登记 CAS 号：3915-83-1
其分子式 C15H26O2 由 15 个碳、26 个氢、2 个氧 组成。
别名/同义词：异戊酸橙花酯 · neryl isovalerate
异戊酸橙花酯 的 CAS 登记号为 3915-83-1。
分子式 C15H26O2，分子量 238.37。
别名/同义词：异戊酸橙花酯、neryl isovalerate。
登记用途：Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index、General Manufacturing Information: Butanoic acid、3-methyl-、(2Z)-3、7-dimethyl-2、6-octadien-1-yl ester: ACTIVE。
异戊酸橙花酯（CAS 3915-83-1）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 3915-83-1 |
|---|---|
| PubChem CID | 6429039 |
| Molecular formula | C15H26O2 |
| IUPAC name | [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate |
| UNII (FDA) | 5RC970J93J |
| FEMA number | 2778 |
| JECFA number | 76 |
| Molecular Weight | 238.37 |
|---|---|
| XLogP3 | 4.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 8 |
| Exact Mass | 238.193280068 |
| Monoisotopic Mass | 238.193280068 |
| Topological Polar Surface Area | 26.3 |
| Heavy Atom Count | 17 |
| Boiling Point | 145.00 °C. @ 15.00 mm Hg |
|---|---|
| Boiling Point | 238 °C |
| Density | 0.889-0.893 |
| Refractive Index | 1.4531-1.460 |
Neryl isovalerate; 3915-83-1; Neryl isovalerianate; Nerol isovalerate; Neryl 3-methylbutanoate; Neryl 3-methylbutyrate; FEMA No. 2778; (Z)-Geranyl isovalerate; Neryl beta-methylbutyrate; Isovaleric acid neryl ester; [(2Z)-3,7-dimethylocta-2,6-dienyl] 3-methylbutanoate; UNII-5RC970J93J; 5RC970J93J; EINECS 223-478-4; Neryl .beta.-methyl butyrate; NERYL ISOVALERATE [FHFI]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVOR ENHANCER, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 2.5% (1 / 40) |
| GHS notification summary | 2.5% (1 / 40) |
|---|---|
| Reported hazard statements | H315 (97.5%), H319 (97.5%), H335 (97.5%) |
This chemical does not meet GHS hazard criteria for 2.5% (1 of 40) of reports.
H315 (97.5%): Causes skin irritation [Warning Skin corrosion/irritation]
neryl isovalerate · CAS 3915-83-1 · C15H26O2. UNII 5RC970J93J. Boiling Point: 145.00 °C. @ 15.00 mm Hg; Boiling Point: 238 °C; Density: 0.889-0.893.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: neryl isovalerate