2,3,4-三甲基-3-戊醇(CAS 3054-92-0):分子式 C8H18O、分子量 130.23。
| CAS号 | 3054-92-0 |
|---|---|
| 分子式 | C8H18O |
| 分子量 | 130.23 |
| 沸点 | 78.00 °C. @ 46.00 mm Hg |
| LogP | 2.5 |
| 应用领域 | Fragrance Ingredients、Used as flavoring agent or adjuvant |
登记用途:Fragrance Ingredients、Used as flavoring agent or adjuvant。
2,3,4-三甲基-3-戊醇 是一种化工化合物,登记 CAS 号为 3054-92-0,分子式 C8H18O(分子量 130.23)。
登记 CAS 号:3054-92-0
其分子式 C8H18O 由 8 个碳、18 个氢、1 个氧 组成。
别名/同义词:2,3,4-三甲基-3-戊醇 · 2,3,4-Trimethyl-3-pentanol
2,3,4-三甲基-3-戊醇 的 CAS 登记号为 3054-92-0。
分子式 C8H18O,分子量 130.23。
别名/同义词:2,3,4-三甲基-3-戊醇、2,3,4-Trimethyl-3-pentanol。
登记用途:Fragrance Ingredients、Used as flavoring agent or adjuvant。
2,3,4-三甲基-3-戊醇(CAS 3054-92-0)的独立参考数据,整理自公开化学数据库。
| CAS Registry Number | 3054-92-0 |
|---|---|
| PubChem CID | 520484 |
| Molecular formula | C8H18O |
| Molecular weight | 130.14 g/mol |
| IUPAC name | 2,3,4-trimethylpentan-3-ol |
| InChIKey | PLSMHHUFDLYURK-UHFFFAOYSA-N |
| UNII (FDA) | E7OYT9FJ8F |
| FEMA number | 3903 |
| JECFA number | 1643 |
| Molecular Weight | 130.23 |
|---|---|
| XLogP3 | 2.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 2 |
| Exact Mass | 130.135765193 |
| Monoisotopic Mass | 130.135765193 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 9 |
| Boiling Point | 78.00 °C. @ 46.00 mm Hg |
|---|---|
| Boiling Point | 156-157 °C |
| Density | 0.846-0.850 |
| Refractive Index | 1.433-1.438 |
2,3,4-Trimethyl-3-pentanol; 3054-92-0; 3-Pentanol, 2,3,4-trimethyl-; 1,1-Diisopropylethanol; Diisopropylmethylcarbinol; FEMA No. 3903; UNII-E7OYT9FJ8F; E7OYT9FJ8F; 2,3,4-Trimethyl-3-pentanol [FHFI]; DTXSID90184621; 1,1Diisopropylethanol; RefChem:81333; 2,3,4Trimethyl3pentanol; 3Pentanol, 2,3,4trimethyl; DTXCID30107112; PLSMHHUFDLYURK-UHFFFAOYSA-N
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: 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 |
|---|
| Reported hazard statements | H226 (96.6%), H302 (95.8%) |
|---|
H226 (96.6%): Flammable liquid and vapor [Warning Flammable liquids]
H302 (95.8%): Harmful if swallowed [Warning Acute toxicity, oral]
2,3,4-Trimethyl-3-pentanol is identified by CAS 3054-92-0, molecular formula C8H18O and molecular weight 130.14 g/mol. UNII E7OYT9FJ8F; InChIKey PLSMHHUFDLYURK-UHFFFAOYSA-N. Boiling Point: 78.00 °C. @ 46.00 mm Hg; Boiling Point: 156-157 °C; Density: 0.846-0.850.
数据来源:PubChem / Wikidata;与随货 COA 不一致时以 COA 为准。
English page: 2,3,4-Trimethyl-3-pentanol