rhodinol (CAS 6812-78-8) — formula C10H20O, molecular weight 156.15 g/mol; category organic chemicals.
| CAS Number | 6812-78-8 |
|---|---|
| Molecular Formula | C10H20O |
| Molecular Weight | 156.15 g/mol |
| Boiling Point | 132-135 °C (4 mm Hg) |
| LogP | 3.5 |
| Applications | Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 7-Octen-1-ol, 3, 7-dimethyl-, (3S)-: ACTIVE |
| Category | Organic Chemicals |
Documented applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 7-Octen-1-ol, 3, 7-dimethyl-, (3S)-: ACTIVE.
rhodinol is a carbon-based organic compound with CAS registry number 6812-78-8 and molecular formula C10H20O (molecular weight 156.15 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 6812-78-8
Its molecular formula C10H20O comprises 10 C, 20 H, 1 O atoms.
Also known as: rhodinol · 玫瑰醇
Category: organic chemicals
The CAS registry number of rhodinol is 6812-78-8.
Molecular formula C10H20O, molecular weight 156.15 g/mol.
It is also registered under: rhodinol, 玫瑰醇.
Recorded applications: Use Classification: Fragrance Ingredients, Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes, Flavoring Agents -> JECFA Flavorings Index, General Manufacturing Information: 7-Octen-1-ol, 3, 7-dimethyl-, (3S)-: ACTIVE.
Category: Organic Chemicals.
Independent reference data for rhodinol (CAS 6812-78-8), compiled from public chemistry databases.
| CAS Registry Number | 6812-78-8 |
|---|---|
| PubChem CID | 81263 |
| Molecular formula | C10H20O |
| Molecular weight | 156.15 g/mol |
| IUPAC name | (3S)-3,7-dimethyloct-7-en-1-ol |
| InChIKey | JGQFVRIQXUFPAH-JTQLQIEISA-N |
| UNII (FDA) | 1V437W60X9 |
| FEMA number | 2980 |
| JECFA number | 1222 |
| Molecular Weight | 156.26 |
|---|---|
| XLogP3 | 3.5 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 6 |
| Exact Mass | 156.151415257 |
| Monoisotopic Mass | 156.151415257 |
| Topological Polar Surface Area | 20.2 |
| Heavy Atom Count | 11 |
| Boiling Point | 132-135 °C (4 mm Hg) |
|---|---|
| Density | 0.860-0.880 |
| Refractive Index | 1.463-1.473 |
Rhodinol; 6812-78-8; (-)-Rhodinol; (-)-alpha-citronellol; FEMA No. 2980; 7-Octen-1-ol, 3,7-dimethyl-, (3S)-; 1V437W60X9; (S)-ALPHA-CITRONELLOL; (S)-3,7-DIMETHYL-7-OCTENOL; DTXCID9027233; RefChem:1098082; 205-473-9; 229-887-4; DTXSID2047193; (3S)-3,7-dimethyloct-7-en-1-ol; 7-Octen-1-ol, 3,7-dimethyl-, (S)-
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: ANTIOXIDANT, FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent No safety concern at current levels of intake when used as a flavouring agent TRS 922-JECFA 61/75 |
|---|
| Reported hazard statements | H315 (100%), H317 (100%), H318 (92.2%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
rhodinol is identified by CAS 6812-78-8, molecular formula C10H20O and molecular weight 156.15 g/mol. UNII 1V437W60X9; InChIKey JGQFVRIQXUFPAH-JTQLQIEISA-N. Boiling Point: 132-135 °C (4 mm Hg); Density: 0.860-0.880; Refractive Index: 1.463-1.473.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 玫瑰醇