2’-Hydroxyacetophenone 2’-羟基苯乙酮

CAS 118-93-4 MFCD00002219

化学结构图

118-93-4
SMILES: CC(=O)c1ccccc1O

化学属性

Mol. FormulaC8H8O2
Mol. Weight136.15
Density1.131
Refractive index1.5570 to 1.5610
Flash Point106°C
TSCAYes
Boiling Point218.4°C at 760 mmHg
Melting Point3-6°C
Vapor Density4.7 (vs air)
Vapor Pressure~0.2 mmHg ( 20 °C)
Stability对光敏感
Solubilityslightly soluble

别名和识别编码

Chemical Name2’-Hydroxyacetophenone
CAS Number118-93-4
Alfabeta NameHYDROXYACETOPHENONE 2-'
MDL NumberMFCD00002219
EC Number204-288-0
Beilstein Registry Number386123
Reaxys-RN386123
PubChem Substance ID8375
Synonym 2'-Hydroxyacetophenone {LY} 2'-Hydroxyacetophenone {} {LY} 2'-Hydroxyacetophenone {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2'-Hydroxyacetophenone {} {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation2’-羟基苯乙酮
Wiswesser Line NotationQR BV1
LabNetwork Molecule IDLN00007990
InChIInChI=1S/C8H8O2/c1-6(9)7-4-2-3-5-8(7)10/h2-5,10H,1H3
Canonical SMILESCC(C1=CC=CC=C1O)=O
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分类

  • {SNA} Alphabetical Listings, Flavors and Fragrances, G-H
  • {Chemicalbook} 食品添加剂: 食用香料(增香剂): 天然等同香料和人造香
  • {SNA} Building Blocks, C7 to C8, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks

产品应用

  • 用于有机合成。

相关文献及参考

  • Beilstein:8,85

安全信息

Warnings IRRITANT
Signal word Warning
GHS Symbol
WGK Germany2
Safety Statements
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • 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
RTECSAM8575000
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
Personal Protective Equipment Eyeshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Hazard Codes Xi
Storage condition 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°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD277-689

其他信息

  • 蒸气压:~0.2 mm Hg ( 20 °C)
  • 检测方法:GC
  • MSDS 信息:2'-Hydroxyacetophenone(118-93-4).msds
  • FEMA:3548
  • Hazard Note:Harmful/Irritant
  • 使用限量:FEMA(mg/kg):焙烤制品、小吃食品,0.2;肉制品、汤品、肉羹、禽制品、调味料、速溶咖啡和茶、家用调味香料,0.1。
  • 下游产品:4-羟基香豆素 --> 3-氯杀鼠灵酮 --> 对羟基苯乙酮 --> 1,2-苯并异噁唑-3-乙酸 --> 4-氨基-苯并吡喃-2-酮 --> 3-甲基苯并呋喃-2-羧酸 --> 2-苄氧基苯乙酮 --> 3-溴色酮,97% --> 3-乙酰氧基苯并[b]呋喃 --> 2,3-二羟芴 --> 色酮-3-甲醛 --> 2-溴-2'-羟基苯乙酮 --> 2-[1-(1H-咪唑-1-基)乙烯基]苯酚 --> 盐酸普罗帕酮
  • 海关编码:29145000
  • TCI Shanghai:2'-羟基苯乙酮 2'-Hydroxyacetophenone,>;98.0%(LC)(T)(118-93-4)
  • 对光敏感。能与乙醇、乙醚和乙酸混溶,微溶于水。有刺激性。
  • Alfa Aesar:2-羟基苯乙酮,,98% 2'-Hydroxyacetophenone, 98%(118-93-4)
  • 对光敏感。能与乙醇、乙醚和乙酸混溶,微溶于水。有刺激性
  • 蒸气密度:4.7 (vs air)
  • 用途三:以羟取代苯甲醛和邻羟基苯乙酮(118-93-4)为原料、哌啶为催化剂,通过羟醛缩合反应合成4,2'-二羟基查尔酮。
  • Acros Organics:邻羟基苯乙酮 2'-Hydroxyacetophenone, 99%(118-93-4)
  • 用途一:用于合成医药中间体
  • 毒性:GRAS(FEMA)。
  • Sigma Aldrich:118-93-4(sigmaaldrich)
  • 外观:白色或淡黄色固体,黄色透明至棕色液体
  • 图谱信息:2'-羟基苯乙酮(118-93-4)质谱(MS) 2'-羟基苯乙酮(118-93-4)红外图谱(IR1) 2'-羟基苯乙酮(118-93-4)核磁图( 13 CNMR) 2'-羟基苯乙酮(118-93-4)Raman光谱 2'-羟基苯乙酮(118-93-4)核磁图( 1 HNMR)
  • 2'-羟基苯乙酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 H0192 2'-羟基苯乙酮 2'-Hydroxyacetophenone 500G 772元 2014/06/02 H0192 2'-羟基苯乙酮 2'-Hydroxyacetophenone 25G 169元 2010/06/21 120930050 2'-羟基苯乙酮 2'-Hydroxyacetophenone 99% 5 GR 200元
  • 食品添加剂最大允许使用量最大允许残留量标准:添加剂中文名称 允许使用该种添加剂的食品中文名称 添加剂功能 最大允许使用量(g/kg) 最大允许残留量(g/kg) 2-羟基苯乙酮 食品 食品用香料 用于配制香精的各香料成分不得超过在GB 2760中的最大允许使用量和最大允许残留量
  • F:8
  • 参考质量标准:FAO/WHO,2000 含量(GT-10-4) ≥95% 折射率(n D 20 ) 1.556~1.560 相对密度(d 25 25 ) 1.127~1.133
  • 用途二:心律平的中间体。
  • MOL 文件:118-93-4.mol

系列性分类


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