12-甲基十三醛（CAS 75853-49-5）：分子式 C14H28O、分子量 212.37。
| CAS号 | 75853-49-5 |
|---|---|
| 分子式 | C14H28O |
| 分子量 | 212.37 |
| 沸点 | 141-143 °C (4 mm Hg) |
| LogP | 5.7 |
| 应用领域 | Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index |
登记用途：Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index。
12-甲基十三醛 是一种化工化合物，登记 CAS 号为 75853-49-5，分子式 C14H28O（分子量 212.37）。
登记 CAS 号：75853-49-5
其分子式 C14H28O 由 14 个碳、28 个氢、1 个氧 组成。
别名/同义词：12-甲基十三醛 · 12-Methyltridecanal
12-甲基十三醛 的 CAS 登记号为 75853-49-5。
分子式 C14H28O，分子量 212.37。
别名/同义词：12-甲基十三醛、12-Methyltridecanal。
登记用途：Use Classification: Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes、Flavoring Agents -> JECFA Flavorings Index。
12-甲基十三醛（CAS 75853-49-5）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 75853-49-5 |
|---|---|
| PubChem CID | 3018619 |
| Molecular formula | C14H28O |
| Molecular weight | 212.21 g/mol |
| IUPAC name | 12-methyltridecanal |
| InChIKey | OQWNKUAZQSLNSR-UHFFFAOYSA-N |
| UNII (FDA) | T2RF910W7E |
| FEMA number | 4005 |
| JECFA number | 1229 |
| Molecular Weight | 212.37 |
|---|---|
| XLogP3 | 5.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 11 |
| Exact Mass | 212.214015512 |
| Monoisotopic Mass | 212.214015512 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 15 |
| Boiling Point | 141-143 °C (4 mm Hg) |
|---|---|
| Density | 0.930-0.941 |
| Refractive Index | 1.445-1.455 |
12-Methyltridecanal; 75853-49-5; 12-MT Aldehyde; Tridecanal, 12-methyl-; T2RF910W7E; FEMA NO. 4005; DTXSID20868381; RefChem:437353; DTXCID10816497; 616-272-4; Isotetradecan-1-al; MFCD10000650; 93843-20-0; Isotetradecanal; 12-Methyl-tridecanal; UNII-T2RF910W7E
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Cooked Meat, Fat, Meat Broth, Tallow No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 0.1% (1 / 1379) |
| GHS notification summary | 0.1% (1 / 1379) |
|---|---|
| Reported hazard statements | H315, H319, H335 (99.9%) |
This chemical does not meet GHS hazard criteria for < 0.1% (1 of 1379) of reports.
H315 (> 99.9%): Causes skin irritation [Warning Skin corrosion/irritation]
12-Methyltridecanal is identified by CAS 75853-49-5, molecular formula C14H28O and molecular weight 212.21 g/mol. UNII T2RF910W7E; InChIKey OQWNKUAZQSLNSR-UHFFFAOYSA-N. Boiling Point: 141-143 °C (4 mm Hg); Density: 0.930-0.941; Refractive Index: 1.445-1.455.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: 12-Methyltridecanal