Geranylacetone (CAS 3796-70-1) — formula C13H22O, molecular weight 194.31.
| CAS Number | 3796-70-1 |
|---|---|
| Molecular Formula | C13H22O |
| Molecular Weight | 194.31 |
| LogP | 3.7 |
Geranylacetone is a chemical compound with CAS registry number 3796-70-1 and molecular formula C13H22O (molecular weight 194.31).
CAS number: 3796-70-1
Its molecular formula C13H22O comprises 13 C, 22 H, 1 O atoms.
Also known as: Geranylacetone · 香叶基丙酮
The CAS registry number of Geranylacetone is 3796-70-1.
Molecular formula C13H22O, molecular weight 194.31.
It is also registered under: Geranylacetone, 香叶基丙酮.
Independent reference data for Geranylacetone (CAS 3796-70-1), compiled from public chemistry databases.
| CAS Registry Number | 3796-70-1 |
|---|---|
| PubChem CID | 1549778 |
| Molecular formula | C13H22O |
| IUPAC name | (5E)-6,10-dimethylundeca-5,9-dien-2-one |
| UNII (FDA) | 9B7RY79U9Z |
| FEMA number | 3542 |
| JECFA number | 1122 |
| Molecular Weight | 194.31 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 6 |
| Exact Mass | 194.167065321 |
| Monoisotopic Mass | 194.167065321 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 14 |
Geranylacetone; Geranyl acetone; 3796-70-1; (5E)-6,10-dimethylundeca-5,9-dien-2-one; 689-67-8; trans-Geranylacetone; (E)-6,10-Dimethylundeca-5,9-dien-2-one; Dihydropseudoionone; (E)-6,10-Dimethyl-5,9-undecadien-2-one; 5,9-Undecadien-2-one, 6,10-dimethyl-; 6,10-Dimethyl-5,9-undecadien-2-one; cis,trans-Geranylacetone; FEMA No. 3542; (E)-geranylacetone; 5,9-Undecadien-2-one, 6,10-dimethyl-, (E)-; (E/Z)-Geranylacetone
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Fruit 2,6-DIMETHYL-2,6-UNDECADIEN-10-ONE |
|---|
| Reported hazard statements | H315 (100%), H319 (10.8%), H335 (10.8%), H411 (89.2%) |
|---|
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
H319 (10.8%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
Geranylacetone · CAS 3796-70-1 · C13H22O. UNII 9B7RY79U9Z.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 香叶基丙酮