3-Ethoxy-2-cyclohexen-1-one 3-乙氧基-2-环己烯-1-酮

CAS 5323-87-5 MFCD00001580

化学结构图

5323-87-5
SMILES: CCOC1=CC(=O)CCC1

化学属性

Mol. FormulaC8H12O2
Mol. Weight140.18
Density0.963
Boiling Point76-78 °C at 1 mmHg
Refractive index1.5020 to 1.5070
Flash Point107°C(lit.)
TSCANo

别名和识别编码

Chemical Name3-Ethoxy-2-cyclohexen-1-one
Synonym 3-Ethoxycyclohex-2-en-1-one {LY} 3-Ethoxycyclohex-2-en-1-one {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Ethoxycyclohex-2-en-1-one {} {} {} {} {} {} {} {
MDL NumberMFCD00001580
CAS Number5323-87-5
PubChem Substance ID79216
Beilstein Registry Number2042049
EC Number226-190-7
Reaxys-RN2042049
Chemical Name Translation3-乙氧基-2-环己烯-1-酮
InChIKeyJWCFJPLIRVYENQ-UHFFFAOYSA-N
LabNetwork Molecule IDLN01070122
InChIInChI=1S/C8H12O2/c1-2-10-8-5-3-4-7(9)6-8/h6H,2-5H2,1H3
Canonical SMILESO=C1C=C(OCC)CCC1
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分类

  • {uni_hamburg} no charge; carbocycle; alicycle; 6RingOnly; 6ring; ketone; ether; 1fragment
  • {SNA} Building Blocks, C7 to C8, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks

相关文献及参考

  • Short: III/35C1
  • Short: III/35E
  • Under conditions of kinetic enolate formation (LDA), alkylation occurs at the 6-position: the Stork-Danheiser kinetic alkylation procedure, which has found extensive use in alicyclic synthesis: J. Org. Chem., 38, 1775 (1973); Org. Synth. Coll., 7, 208 (1990) and references therein.
  • Useful intermediate for the preparation of 3-alkyl- or aryl-2-cyclohexen-1-ones, by addition of organometallic reagents and subsequent hydrolysis: J. Am. Chem. Soc., 70, 2174 (1948); 72, 1645 (1950); Helv. Chim. Acta, 36, 482 (1963). For an example of this transformation in the total synthesis of axane sesquiterpenoids, see: J. Org. Chem., 61, 473 (1996):

安全信息

WGK Germany3
Personal Protective Equipment Eyeshields, Gloves
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
Storage condition 2-8°C {LY} 2-8°C Store at room temperature {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适，呼叫解毒中心或医生/医师。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
GHS Symbol

其他信息

  • TCI Shanghai:3-乙氧基-2-环己烯-1-酮 3-Ethoxy-2-cyclohexen-1-one,>;98.0%(GC)(5323-87-5)
  • Sigma Aldrich:5323-87-5(sigmaaldrich)
  • Alfa Aesar:3-乙氧基-2-环己烯-1-酮,99% 3-Ethoxy-2-cyclohexen-1-one, 99%(5323-87-5)
  • 3-乙氧基-2-环己烯-1-酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 E0384 3-乙氧基-2-环己烯-1-酮 3-Ethoxy-2-cyclohexen-1-one 25ML 928元 2014/06/02 E0384 3-乙氧基-2-环己烯-1-酮 3-Ethoxy-2-cyclohexen-1-one 5ML 299元 2010/06/21 117880100 3-乙氧基-2-环己烯-1-酮 3-Ethoxy-2-cyclohexen-1-one 99% 10 GR 412元
  • Acros Organics:3-乙氧基-2-环己烯-1-酮 3-Ethoxy-2-cyclohexen-1-one, 99%(5323-87-5)
  • MOL 文件:5323-87-5.mol

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C7 to C8 - Ketones
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones 酮
  6. C3 to C6
  1. Functional Group 官能团索引
  2. enol ether

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