4-Ethylphenol 4-乙基苯酚

CAS 123-07-9 MFCD00002393

化学结构图

123-07-9
SMILES: CCC1CCC(O)CC1

化学属性

Mol. FormulaC8H10O
Mol. Weight122.17
Boiling Point218-219°C at 760 mmHg
Melting Point40-42 °C
Density1.011
Refractive index1.5330
Flash Point100.56°C
TSCAYes
Vapor Density4.2 (vs air)
Vapor Pressure0.13 mmHg ( 20 °C)
Solubility4.9 G/L (25 ºC)
Appearance D 20 天然品存在于鸡蛋果、欧洲酸蔓果、猪肉、朗姆酒、威士忌、咖啡等中。 )1.011,折射率(n 25 4 )1.5239。微溶于水,易溶于乙醇、乙醚、丙酮、苯和二硫化碳中。 无色或白色针状结晶,可因光照而变黄。呈强烈木-酚气息,有轻微香甜香气。熔点41~43℃,沸点218~219℃,闪点100℃。相对密度(d

别名和识别编码

Chemical Name4-Ethylphenol
CAS Number123-07-9
PubChem Substance ID31242
EC Number204-598-6
Beilstein Registry Number6(3)1663
MDL NumberMFCD00002393
Reaxys-RN1363317
Synonym 4-Ethylphenol {LY} 4-Ethylphenol {} {LY} 4-Ethylphenol {} {} {LY} 4-Ethylphenol {} {} {} {LY} 4-Ethylphenol {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-Ethylphenol {} {} {} {} {} {} {} {}
Chemical Name Translation4-乙基苯酚
LabNetwork Molecule IDLN00226717
InChIInChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3
Canonical SMILESOC1=CC=C(CC)C=C1
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分类

  • {Chemicalbook} 食品添加剂: 食用香料(增香剂): 天然等同香料和人造香
  • {SNA} Alphabetical Listings, E-F, Flavors and Fragrances, Halal Certified Products, Kosher Certified Products, O-Z
  • {SNA} Alphabetical Listings, Certified Food Grade Products, E - H, E-F, E-G, Flavors and Fragrances,

相关文献及参考

  • Aldrich MSDS 1 , 928:C / Arctander , 1329 / Corp MSDS 1 (1), 1646:A / FT-IR 1 (1), 1076:A / FT-IR 2 (2), 1843:C / FT-NMR 1 (2), 251:A / Fenaroli , 262 / IR-Spectra (2), 577:D / IR-Spectra (3), 647:F / NMR-Reference 2 (1), 873:B / RegBook 1 (1), 1269:G / RegBook 29 (1), 1269:G / Structure Index 1 , 193:A:1 / Vapor Phase 3 , 1008:B
  • Beil. 6 ,IV,3020
  • Short: II/25D Title: Structure Data of Free Polyatomic Molecules: Molecules Containing Five or More Carbon Atoms Author: Graner, G.; Hirota, E.; Iijima, T.; Kuchitsu, K.; Ramsay, D.A.; Vogt, J.; Vogt, N. Editor: Kuchitsu, K. Source: Landolt-Börnstein, New Series Volume: II/25D Year: 2003 Keyword: Free Polyatomic Molecules; Carbon Atoms; Molecules ISBN: 3-540-42860-7 ISBN: 978-3-540-42860-2 Internet Resource: DOI:10.1007/b75952 RefComment: VIII, 569 pages. Hardcover RefComment: Written for scientists and researchers in the fields of chemistry and physics Abstract: This fourth

安全信息

GHS Symbol
WGK Germany1
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
  • H302+H312+H332
  • H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes C
RTECSSL4040000
Precautionary statements
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • 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。
  • P305+P351+P338+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • 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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P301+P330+P331+P310
  • P303+P361+P353
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
Signal word Danger
UN Number UN2430 UN 2430 8/PG 3 2430
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
  • R21/22 Harmful in contact with skin and if swallowed 皮肤接触和不慎吞咽有害
  • R34 Causes burns 会导致灼伤
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • 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;
  • S60 This material and its container must be disposed of as hazardous waste 该物质及其容器必须作为危险废物处置;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Packing GroupIII
Hazard Class8
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 138 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 18,868,1975

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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

  • 上游原料:铜 --> 乙基苯
  • 毒性:GRAS(FEMA)。
  • 蒸气压:0.13 mm Hg ( 20 °C)
  • MOL 文件:123-07-9.mol
  • 用途二:GB 2760--1996规定为允许使用的食品用香料。用于配制感士忌、朗姆酒、熏猪肉、火腿、咖啡等香精。
  • TCI Shanghai:4-乙基苯酚 4-Ethylphenol,>;97.0%(GC)(123-07-9)
  • 下游产品:苯乙基苯基聚氧乙烯聚氧丙烯醚 --> 苯乙烯基苯酚聚氧乙烯(16)醚 --> 苯乙基苯酚聚氧乙烯(10)醚 --> 苯乙基苯酚聚氧乙烯醚
  • Alfa Aesar:4-乙基苯酚,97% 4-Ethylphenol, 97%(123-07-9)
  • 图谱信息:4-乙基苯酚(123-07-9)红外图谱(IR1) 4-乙基苯酚(123-07-9)核磁图( 13 CNMR) 4-乙基苯酚(123-07-9)质谱(MS) 4-乙基苯酚(123-07-9)核磁图( 1 HNMR) 4-乙基苯酚(123-07-9)红外图谱(IR2) 4-乙基苯酚(123-07-9)红外图谱(IR3)
  • Sigma Aldrich:123-07-9(sigmaaldrich)
  • 海关编码:29071900
  • MSDS 信息:4-Ethylphenol(123-07-9).msds
  • 参考质量标准:FAO/WHO,2000 含量(GT-10-4) ≥99% 熔点 47~48℃
  • 用途一:是重要的农药中间体,可生产系列高档、低毒、低残留农药
  • Acros Organics:对乙基苯酚 4-Ethylphenol, 97%(123-07-9)
  • 方法一:由苯酚与乙烯或乙醇进行催化反应而得。 由4-氯代乙基苯与氢氧化钠在铜粉催化下加热反应而得。
  • FEMA:3156
  • 使用限量:FEMA(mg/kg):焙烤食品、人造奶油,0.20。
  • 蒸气密度:4.2 (vs air)
  • 4-乙基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 E0159 4-乙基苯酚 4-Ethylphenol 25G 117元 2014/06/02 E0159 4-乙基苯酚 4-Ethylphenol 500G 558元 2010/06/21 118820010 4-乙基苯酚 4-Ethylphenol 97% 1 KG 1840元

系列性分类


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