3-methylpentan-1-ol (CAS 589-35-5) — formula C6H14O, molecular weight 102.17; category organic chemicals.
3-methylpentan-1-ol is a carbon-based organic compound with CAS registry number 589-35-5 and molecular formula C6H14O (molecular weight 102.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 589-35-5
Its molecular formula C6H14O comprises 6 C, 14 H, 1 O atoms.
Also known as: 3-methylpentan-1-ol · 3-METHYL-1-PENTANOL
Category: organic chemicals
The CAS registry number of 3-methylpentan-1-ol is 589-35-5.
Molecular formula C6H14O, molecular weight 102.17.
It is also registered under: 3-methylpentan-1-ol, 3-METHYL-1-PENTANOL.
Category: Organic Chemicals.
Public-database records for 3-methylpentan-1-ol (CAS 589-35-5), reproduced here for independent cross-checking.
| GHS notification summary | 9.2% (135 / 1467) |
|---|---|
| Reported hazard statements | H226 (90.8%) |
This chemical does not meet GHS hazard criteria for 9.2% (135 of 1467) of reports.
H226 (90.8%): Flammable liquid and vapor [Warning Flammable liquids]
| 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 |
|---|---|
| GHS notification summary | 9.2% (135 / 1467) |
| 沸点 | 151.00 to 152.00 °C. @ 760.00 mm Hg |
|---|---|
| 沸点 | 151-152 °C |
| 密度 | 0.823 |
| 折射率 | 1.418 |
| CAS Registry Number | 589-35-5 |
|---|---|
| PubChem CID | 11508 |
| 分子式 | C6H14O |
| IUPAC 名称 | 3-methylpentan-1-ol |
| UNII（FDA） | N8W93SI0FS |
| FEMA 编号 | 3762 |
| JECFA 编号 | 263 |
3-METHYL-1-PENTANOL; 3-Methylpentan-1-ol; 589-35-5; 3-Methylpentanol; 2-Ethyl-4-butanol; 1-Pentanol, 3-methyl-; 3-Ethyl-1-butanol; FEMA No. 3762; N8W93SI0FS; NSC-9466; CHEBI:87381; DTXSID20862248; RefChem:94705; DTXCID50811042; 209-644-9; MFCD00002937
| 分子量 | 102.17 |
|---|---|
| XLogP3 | 1.8 |
| 氢键供体数 | 1 |
| 氢键受体数 | 1 |
| 可旋转键数 | 3 |
| 精确质量 | 102.104465066 |
| 单同位素质量 | 102.104465066 |
| 拓扑极性表面积 | 20.2 |
| 重原子数 | 7 |
| 形式电荷 | 0 |
3-methylpentan-1-ol · CAS 589-35-5 · C6H14O. UNII N8W93SI0FS. 沸点: 151.00 to 152.00 °C. @ 760.00 mm Hg; 沸点: 151-152 °C; 密度: 0.823.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd. · Reply within one business day.