3-Octanon-1-ol，CAS 登记号 65405-68-7，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于Flavors。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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本页已列出 3-Octanon-1-ol 的 CAS 号：65405-68-7，可与随货 COA 核对。
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3-Octanon-1-ol is identified by CAS 65405-68-7, molecular formula C8H16O2 and molecular weight 144.12 g/mol. UNII NWU4UN7SMJ; ChEBI 179943; InChIKey MHOXVRWQBOAOAU-UHFFFAOYSA-N. Boiling Point: 94.00 to 96.00 °C. @ 9.00 mm Hg; Boiling Point: 94.6 °C (8-9 mm Hg); Density: 0.945-0.949.
| CAS Registry Number | 65405-68-7 |
|---|---|
| PubChem CID | 5362561 |
| Molecular formula | C8H16O2 |
| Molecular weight | 144.12 g/mol |
| IUPAC name | 3-(hydroxymethyl)heptan-2-one |
| InChIKey | MHOXVRWQBOAOAU-UHFFFAOYSA-N |
| UNII (FDA) | NWU4UN7SMJ |
| ChEBI ID | CHEBI:179943 |
| FEMA number | 2804 |
| JECFA number | 604 |
| Molecular Weight | 144.21 |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 5 |
| Exact Mass | 144.115029749 |
| Monoisotopic Mass | 144.115029749 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 10 |
| Formal Charge | 0 |
| Boiling Point | 94.00 to 96.00 °C. @ 9.00 mm Hg |
|---|---|
| Boiling Point | 94.6 °C (8-9 mm Hg) |
| Density | 0.945-0.949 |
| Refractive Index | 1.444-1.447 |
| Regulatory & Food Contact | 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 Secondary components do not raise a safety concern. |
|---|---|
| GHS notification summary | 100% (89 / 89) |
| GHS notification summary | 100% (89 / 89) |
|---|
This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.
Reported as not meeting GHS hazard criteria by 89 of 89 companies. For more detailed information, please visit ECHA C&L website.
3-(Hydroxymethyl)heptan-2-one; 3-Octanon-1-ol; 3-(Hydroxymethyl)-2-heptanone; 2-Heptanone, 3-(hydroxymethyl)-; FEMA No. 2804; NWU4UN7SMJ; UNII-NWU4UN7SMJ; EINECS 265-739-5; DTXSID30867143; 3-OCTANON-1-OL [FHFI]; 3-HYDROXYMETHYL-2-HEPTANONE; 3-BUTYL-4-HYDROXY-2-BUTANONE; RefChem:92655; DTXCID10815349; (+-)-3-(HYDROXYMETHYL)-2-HEPTANONE; 3-(HYDROXYMETHYL)-2-HEPTANONE, (+-)-
CAS 65405-68-7; molecular formula C8H16O2; molecular weight 144.12 g/mol.
3-(Hydroxymethyl)heptan-2-one, 3-Octanon-1-ol, 3-(Hydroxymethyl)-2-heptanone, 2-Heptanone, 3-(hydroxymethyl)-, FEMA No. 2804, NWU4UN7SMJ.
Documented regulatory listings: FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; Flavoring Agents; FLAVOURING_AGENT: Flavouring Agent.
100% of GHS notifications report no hazard classification (89 of 89).
Boiling Point: 94.00 to 96.00 °C. @ 9.00 mm Hg; Boiling Point: 94.6 °C (8-9 mm Hg); Density: 0.945-0.949; Refractive Index: 1.444-1.447.
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.