S-3,7-Dimethyl-1-octanol (CAS 68680-98-8) — formula C10H22O, molecular weight 158.28; category organic chemicals.
| CAS Number | 68680-98-8 |
|---|---|
| Molecular Formula | C10H22O |
| Molecular Weight | 158.28 |
| Boiling Point | 213 °C |
| LogP | 3.6 |
| Applications | Fragrance, Fragrance Ingredients |
| Category | Organic Chemicals |
Documented applications: Fragrance, Fragrance Ingredients.
S-3,7-Dimethyl-1-octanol is a carbon-based organic compound with CAS registry number 68680-98-8 and molecular formula C10H22O (molecular weight 158.28), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 68680-98-8
Its molecular formula C10H22O comprises 10 C, 22 H, 1 O atoms.
Also known as: S-3,7-Dimethyl-1-octanol · S-3,7-二甲基-1-辛醇
Category: organic chemicals
The CAS registry number of S-3,7-Dimethyl-1-octanol is 68680-98-8.
Molecular formula C10H22O, molecular weight 158.28.
It is also registered under: S-3,7-Dimethyl-1-octanol, S-3,7-二甲基-1-辛醇.
Recorded applications: Fragrance, Fragrance Ingredients.
Category: Organic Chemicals.
Independent reference data for S-3,7-Dimethyl-1-octanol (CAS 68680-98-8), compiled from public chemistry databases.
| CAS Registry Number | 68680-98-8 |
|---|---|
| PubChem CID | 7792 |
| Molecular formula | C10H22O |
| IUPAC name | 3,7-dimethyloctan-1-ol |
| UNII (FDA) | DPY9K1927C |
| FEMA number | 2391 |
| JECFA number | 272 |
| Molecular Weight | 158.28 |
|---|---|
| XLogP3 | 3.6 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 6 |
| Exact Mass | 158.167065321 |
| Monoisotopic Mass | 158.167065321 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 11 |
| Boiling Point | 213 °C |
|---|---|
| Density | 0.826-0.842 |
| Refractive Index | 1.435-1.445 |
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
| 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) |
| 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]
S-3,7-Dimethyl-1-octanol · CAS 68680-98-8 · C10H22O. UNII DPY9K1927C. Boiling Point: 213 °C; Density: 0.826-0.842; Refractive Index: 1.435-1.445.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: S-3,7-二甲基-1-辛醇