(E)-3-Hepten-2-one (CAS 5609-09-6) — formula C7H12O, molecular weight 112.17; category organic chemicals.
| CAS Number | 5609-09-6 |
|---|---|
| Molecular Formula | C7H12O |
| Molecular Weight | 112.17 |
| Boiling Point | 63.00 °C. @ 13.00 mm Hg |
| LogP | 1.7 |
| Category | Organic Chemicals |
(E)-3-Hepten-2-one is a carbon-based organic compound with CAS registry number 5609-09-6 and molecular formula C7H12O (molecular weight 112.17), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 5609-09-6
Its molecular formula C7H12O comprises 7 C, 12 H, 1 O atoms.
Also known as: (E)-3-Hepten-2-one · (E)-3-庚烯-2-酮
Category: organic chemicals
The CAS registry number of (E)-3-Hepten-2-one is 5609-09-6.
Molecular formula C7H12O, molecular weight 112.17.
It is also registered under: (E)-3-Hepten-2-one, (E)-3-庚烯-2-酮.
Category: Organic Chemicals.
Independent reference data for (E)-3-Hepten-2-one (CAS 5609-09-6), compiled from public chemistry databases.
| CAS 号 | 5609-09-6 |
|---|---|
| PubChem CID | 5364578 |
| 分子式 | C7H12O |
| IUPAC 名称 | (E)-hept-3-en-2-one |
| UNII（FDA） | TK02T5FJDO |
| FEMA 编号 | 3400 |
| JECFA 编号 | 1127 |
| Molecular Weight | 112.17 |
|---|---|
| XLogP3 | 1.7 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 3 |
| Exact Mass | 112.088815002 |
| Monoisotopic Mass | 112.088815002 |
| Topological Polar Surface Area | 17.1 |
| Heavy Atom Count | 8 |
| Boiling Point | 63.00 °C. @ 13.00 mm Hg |
|---|---|
| Boiling Point | 162 °C |
| Density | 0.841-0.847 |
| Refractive Index | 1.439-1.448 |
3-HEPTEN-2-ONE; 1119-44-4; Butylideneacetone; (3E)-Hept-3-en-2-one; (E)-3-Hepten-2-one; Methyl pentenyl ketone; 3-Hepten-2-one, (E)-; Trans-3-hepten-2-one; FEMA No. 3400; TK02T5FJDO; DTXSID7061510; RefChem:94012; 3-hepten-2-one, trans-; DTXCID1033246; 214-278-8; (E)-hept-3-en-2-one
| 法规与食品接触 | 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 通报统计 | 0.8% (11 / 1445) |
| GHS 通报统计 | 0.8% (11 / 1445) |
|---|---|
| 已通报的危害声明 | H226 (99.2%) |
(E)-3-庚烯-2-酮 · CAS 5609-09-6 · C7H12O. UNII TK02T5FJDO. Boiling Point: 63.00 °C. @ 13.00 mm Hg; Boiling Point: 162 °C; Density: 0.841-0.847.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: (E)-3-庚烯-2-酮