3,7-Dimethyl-1-octanol (CAS 106-21-8) — formula C10H22O, molecular weight 158.28; category organic chemicals.
Documented applications: Fragrance, Fragrance Ingredients.
3,7-Dimethyl-1-octanol is a carbon-based organic compound with CAS registry number 106-21-8 and molecular formula C10H22O (molecular weight 158.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 106-21-8
Its molecular formula C10H22O comprises 10 C, 22 H, 1 O atoms.
Also known as: 3,7-Dimethyl-1-octanol · Dimethyl Octanol · Tetrahydrogeraniol
Category: organic chemicals
The CAS registry number of 3,7-Dimethyl-1-octanol is 106-21-8.
Molecular formula C10H22O, molecular weight 158.28.
It is also registered under: 3,7-Dimethyl-1-octanol, Dimethyl Octanol, Tetrahydrogeraniol.
Recorded applications: Fragrance, Fragrance Ingredients.
Category: Organic Chemicals.
Public-database records for 3,7-Dimethyl-1-octanol (CAS 106-21-8), reproduced here for independent cross-checking.
| GHS notification summary | 3.5% (63 / 1818) |
|---|---|
| Reported hazard statements | H315 (96.5%), H319 (93.8%), H411 (93.1%) |
This chemical does not meet GHS hazard criteria for 3.5% (63 of 1818) of reports.
H315 (96.5%): Causes skin irritation [Warning Skin corrosion/irritation]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: 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 | 3.5% (63 / 1818) |
| 沸点 | 213 °C |
|---|---|
| 密度 | 0.826-0.842 |
| 折射率 | 1.435-1.445 |
| CAS Registry Number | 106-21-8 |
|---|---|
| PubChem CID | 7792 |
| 分子式 | C10H22O |
| 分子量 | 158.17 g/mol |
| IUPAC 名称 | 3,7-dimethyloctan-1-ol |
| InChIKey | PRNCMAKCNVRZFX-UHFFFAOYSA-N |
| UNII（FDA） | DPY9K1927C |
| ChEBI 编号 | CHEBI:195928 |
| FEMA 编号 | 2391 |
| JECFA 编号 | 272 |
3,7-Dimethyloctan-1-ol; 3,7-Dimethyl-1-octanol; 106-21-8; Tetrahydrogeraniol; Dihydrocitronellol; Geraniol tetrahydride; 1-OCTANOL, 3,7-DIMETHYL-; Dimethyl octanol; Geraniol, perhydro-; FEMA No. 2391; DTXSID5044360; DPY9K1927C; NSC-18917; DTXCID3024360; RefChem:587712; 203-374-5
| 分子量 | 158.28 |
|---|---|
| XLogP3 | 3.6 |
| 氢键供体数 | 1 |
| 氢键受体数 | 1 |
| 可旋转键数 | 6 |
| 精确质量 | 158.167065321 |
| 单同位素质量 | 158.167065321 |
| 拓扑极性表面积 | 20.2 |
| 重原子数 | 11 |
| 形式电荷 | 0 |
Tetrahydrogeraniol is identified by CAS 106-21-8, molecular formula C10H22O and molecular weight 158.17 g/mol. UNII DPY9K1927C; ChEBI 195928; InChIKey PRNCMAKCNVRZFX-UHFFFAOYSA-N. 沸点: 213 °C; 密度: 0.826-0.842; Refractive Index: 1.435-1.445.
Source: PubChem / Wikidata; the batch COA governs where values differ.
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