3-octanone is a dialkyl ketone that is octane in which the two methylene protons at position 3 have been replaced by an oxo group.
定义
3-octanone is a dialkyl ketone that is octane in which the two methylene protons at position 3 have been replaced by an oxo group. It has a role as an antifeedant, an insect attractant, a toxin, a biomarker, a plant metabolite, a fungal metabolite and a human urinary metabolite. It derives from a hydride of an octane.
来源: PubChem
美国FDA 物质登记 · UNII 79173B4107 · 登记名称 3-OCTANONE · 单一化学物质
化妆品中的作用
安全与法规参考
未列入韩国有毒物质 GHS 分类 · 现有化学物质
详细资料——标示名称、识别编号、物性、试验记录、文献
别名和识别信息
- CAS No.化学物质登记号
- 106-68-3
- EC No.欧盟化学品目录编号
- 203-423-0
- DTXSID美国EPA化学品编号
- DTXSID3041954
- DTXCID美国EPA化合物编号
- DTXCID1021954
- IUPAC
- Octan-3-one
- 分子式
- C8H16O
- 分子量
- 128.215 g/mol
实测物性
- 性状
- Ethyl n-amyl ketone appears as a clear colorless liquid with a pungent odor. Insoluble in water and partially soluble in alcohol. Vapors are denser than air and may have a narcotic effect in high concentrations. Used in making perfumes and as a solvent for nitrocellulose and vinyl resins. · Liquid
- 气味
- Mild fruity odor
- 沸点
- 332.6 to 334.4 °F at 760 mmHg (USCG, 1999) · 167.5 °C
- 熔点
- -23.00 °C. @ 760.00 mm Hg
- 溶解性
- Slightly miscible (USCG, 1999) · Miscible with ethanol, ether
- 密度
- 0.822 (USCG, 1999) - Less dense than water, will float · 0.820-0.824 at 20 °C/20 °C
- 颜色
- 无色
- 熔点/凝固点
- -18.5 ℃
- 初沸点和沸程
- 167 ℃(at 749㎜Hg)
- 闪点
- 43 ℃
- 蒸气压
- 2 ㎜Hg (at 20℃)
- 溶解度
- 2600 ㎎/ℓ
- 蒸气密度
- 4.4
- 比重
- 0.8221
- 正辛醇/水分配系数(Kow)
- 2.22 ((估算值))
- 自燃温度
- 330 ℃
- 黏度
- (0.9 mPas (20 C))
- 分子量
- 128.21
这是对物质本身测得的数值。韩国安全保健公团(KOSHA)的资料仅供编写和审核安全数据表参考,并非原料商品的规格。
来源: PubChem · 韩国安全保健公团 安全数据表
产品实际使用的用途
这是向美国 EPA 申报含该成分的 9 款产品的用途。其中包括化妆品以外的产品,排在前几行的即为该成分的主要用途。
- Fragrance7
- Flavouring and nutrient2
来源: 美国EPA CompTox
刺激与致敏试验记录
记录有皮肤试验 5 项、眼部试验 2 项。
各项试验结论不一(最多的结论占 25%),因此不能断定该成分有刺激性。 这是对原料本身的试验记录,与成品中所含浓度下的刺激性不同。
查看全部 7 项试验
- Not likely to be sensitizing
skin sensitisation: in vivo (LLNA) · Screening · according to OECD Guideline 429 (Skin Sensitisation: Local Lymph Node Assay) adopted 22 July 2010 according to EU Method B.42 (Skin Sensitisation: Local Lymph Node Assay) No. 440/2008 - Not classified
Skin Sensitization · Screening - Category 2
Skin Irritation · Screening - Severe Irritation
skin irritation: in vivo · Screening · OECD Guideline 404 (Acute Dermal Irritation / Corrosion) adopted 24 April 2002) according to EU Method B.4 (Acute Toxicity: Dermal Irritation / Corrosion) No. 440/2008 according to - Category 6.3B (Category 3)
Skin Irritation · Read Across - Classification not possible
Eye Irritation · Screening - Studies Indicate No Significant Irritation
eye irritation: in vivo · Screening · OECD Guideline 405 (Acute Eye Irritation / Corrosion) 24 April 2002 according to EU Method B.5 (Acute Toxicity: Eye Irritation / Corrosion) No. 440/2008 according to
来源: 美国EPA CompTox