Isobutyl benzoate 苯甲酸异丁酯

CAS 120-50-3 MFCD00048344

化学结构图

120-50-3
SMILES: CC(C)COC(=O)c1ccccc1

化学属性

Mol. FormulaC11H14O2
Mol. Weight178
Density0.994
Refractive index1.4920 to 1.4960
Flash Point120°C(lit.)
TSCAYes
Boiling Point242°
Appearance 无色油状液体。沸点242℃,相对密度0.994-0.997,折射率1.493-1.496,闪点96℃,溶于2体积80%乙醇与油类中,酸值≤1.0。有清甜带涩的琥珀香,略有玫瑰、鸢尾和香叶底蕴的叶青气息,气势虽弱,但鲜而愉快,留香相当持久。

别名和识别编码

Chemical NameIsobutyl benzoate
Synonym ISOBUTYL BENZOATE Benzoicacid,2-methylpropylester 苯甲酸異丁酯 Benzoic acid isobutyl ester 2-Methylpropyl benzoate Benzoic acid, 2-methylpropyl ester benzoicacid2-methylpropylester 苯甲酸异丁酯 ISOBUTYL BENZOATE 98+% 苯甲酸-2-甲基丙酯 Isobutylbenzoat Isobutyl benzoate Benzoic acid, isobutyl ester Benzoic acid iso-butyl ester Benzoesäureisobutylester (2-methyl-1-propyl)benzoate Benzoesäure-isobutylester Benzoic acid isobutyl 2-Methylpropylbenzoat benzoic acid isobutyl ester (2-methyl-1-propyl) benzoate FEMA 2185 benzoic acid 2-methylpropyl ester Isobutylphenylmethanoat BENZOIC ACID ISOBUTYL ESTER 2-METHYLPROPYL BENZOATE
MDL NumberMFCD00048344
CAS Number120-50-3
EC Number204-401-3
Beilstein Registry Number9(3)394
PubChem Substance ID87563274
Reaxys-RN2045961
Chemical Name Translation苯甲酸异丁酯
LabNetwork Molecule IDLN01740256
信息真实价格透明    资金保障    专业采购外包团队在线服务   
信息真实价格透明    资金保障    专业采购外包团队在线服务   
品牌质保精细包装    现货库存    一流品牌服务   

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
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ester; 1fragment
  • {SNA} Alphabetical Listings, Flavors and Fragrances, I-L, I-N, Kosher Certified Products

相关文献及参考

  • Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains the inorganic, organometallic, and organononmetallic liquids, and the binary liquid mixtures (about 900 pure substances and their mixtures). Part B contains data of more than 7600 organic liquids.
  • Short: IV/16 Title: Surface tension of pure liquids and binary mixtures Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: IV/16 Year: 1997 Keyword: organic compounds; surface tension; liquids; mixtures ISBN: 3-540-63276-X ISBN: 978-3-540-63276-4 Internet Resource: DOI:10.1007/b60566 RefComment: VII, 439 pages.
  • Short: IV/20B Title: Vapor Pressure and Antoine Coefficients for Oxygen Containing Organic Compounds Author: Dykyj, J.; Svoboda, J.; Wilhoit, R.C.; Frenkel, M.; Hall, K.R. Editor: Hall, K.R. Source: Landolt-Börnstein, New Series Volume: IV/20B Year: 2000 Keyword: organic compounds; vapor pressure ISBN: 3-540-64968-9 ISBN: 978-3-540-64968-7 Internet Resource: DOI:10.1007/b71424 RefComment: VII, 320 pages.
  • Short: IV/6 Title: Static Dielectric Constants of Pure Liquids and Binary Liquid Mixtures Author: Wohlfarth, Ch. Editor: Madelung, O. Source: Landolt-Börnstein, New Series Volume: IV/6 Year: 1991 Keyword: organic compounds; dielectric constant; liquids; mixtures ISBN: 3-540-54417-8 ISBN: 978-3-540-54417-3 Internet Resource: DOI:10.1007/b44266 RefComment: VIII, 521 pages.
  • Short: EINECS Title: EI

安全信息

RTECSDH4185000
WGK Germany2
Personal Protective Equipment Eyeshields, Gloves
Safety Statements
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触;
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 4800 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TOVEFN Toksikologicheskii Vestnik.  (18-20 Vadkovskii per.  Moscow, 101479,
   Russia) History Unknown  Volume(issue)/page/year: (4),40,1994

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 5600 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   TOVEFN Toksikologicheskii Vestnik.  (18-20 Vadkovskii per.  Moscow, 101479,
   Russia) History Unknown  Volume(issue)/page/year: (4),40,1994

其他信息

  • Alfa Aesar:苯甲酸异丁酯,99% Isobutyl benzoate, 99%(120-50-3)
  • 用途一:可用于玫瑰、香石竹、风信子、橙花、甜豆、鸢尾、紫罗兰、兰花、栀子、晚香玉、刺槐、三叶草、龙涎香-琥珀香等香型中,是花香与非花香的很好的和合剂与定香剂。与岩蔷薇制品共用效果很好。适用于香皂、薰香用香精。还可用于浆果、鲜果、樱桃、凤梨、梅子等食用香精中。
  • Acros Organics:苯甲酸异丁酯 Isobutyl benzoate, 98%(120-50-3)
  • 使用限量:FEMA(mg/kg):饮料2.0~9.0;冷饮7.9;糖果12;焙烤制品10~23。 适量为限(FDA,§172.515,2001)。
  • 图谱信息:苯甲酸异丁酯(120-50-3)核磁图( 13 CNMR) 苯甲酸异丁酯(120-50-3)质谱(MS) 苯甲酸异丁酯(120-50-3)红外图谱(IR1) 苯甲酸异丁酯(120-50-3)红外图谱(IR2)
  • Sigma Aldrich:120-50-3(sigmaaldrich)
  • 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) 苯甲酸异丁酯 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
  • MOL 文件:120-50-3.mol
  • FEMA:2185
  • TCI Shanghai:苯甲酸-2-甲基丙酯 Benzoic Acid Isobutyl Ester,>;99.0%(GC)(120-50-3)
  • 参考质量标准:FAO/WHO,2001 含量(GT-10-4) ≥98% 酸值(OT-4) ≤1.0 折射率(n D 20 ) 1.489~1.496 相对密度(d 25 25 ) 0.994~0.999
  • 苯甲酸异丁酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 B0072 苯甲酸异丁酯 Isobutyl Benzoate 500G 863元 2014/06/02 B0072 苯甲酸异丁酯 Isobutyl Benzoate 25G 156元 2010/06/21 350671000 苯甲酸异丁酯 Isobutyl benzoate 98% 100 GR 498元
  • 毒性:GRAS(FEMA)。

系列性分类


相关产品推荐