Methyl Valerate 戊酸甲酯

CAS 624-24-8 MFCD00009478

化学结构图

624-24-8
SMILES: CCCCC(=O)OC

化学属性

Mol. FormulaC6H12O2
Mol. Weight116
Refractive index1.3950 to 1.3990
Boiling Point128
Density0.875
Flash Point29°C(lit.)
TSCAYes
Melting Point-91.0°C
Solubility微溶于水,可混溶于乙醇、乙醚。

别名和识别编码

Chemical NameMethyl Valerate
Synonym C5 C6H12O2 (pentanoic acid methyl ester) CH3(CH2)3COOCH3 FEMA 2752 METHYL N-PENTANOATE METHYL N-VALERATE METHYL PENTANOATE METHYL VALERATE METHYL VALERATE 99+% METHYL VALERATE GC STANDARD METHYL VALERATE MIN. 99,9 % FOR GAS CHRO MATOGRAPHY METHYL VALERATE OEKANAL METHYL VALERATE, STANDARD FOR GC Methyl ester of pentanoic acid Methyl n-valerate Methyl pentanoate Methyl valerate Methyl valerianate Methylpentanoat Methylvaleart Methylvalerat Methylvaleriat N-VALERIC ACID METHYL ESTER PENTANOIC ACID METHYL ESTER Pentanoic acid, methyl ester Pentansäuremethylester {LY}
CAS Number624-24-8
PubChem Substance ID87577805
EC Number210-838-0
Beilstein Registry Number1741905
MDL NumberMFCD00009478
Reaxys-RN1741905
Chemical Name Translation戊酸甲酯
Wiswesser Line Notation4VO1
LabNetwork Molecule IDLN00195951
InChIInChI=1S/C6H12O2/c1-3-4-5-6(7)8-2/h3-5H2,1-2H3
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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} All Alphabetically Sorted, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Biochemicals and Reagents, Chemical Class, Chromatography, Ester, Esters, FAMEs, Fatty Acids, Fatty Acyls, Fatty Esters, Flavors and Fragrances, Food & Beverage Standards, Lipid Analytical Standards, Lipids, Lipids - FA/FAME/Oils/Sterols,
  • {SNA} Alphabetical Listings, Certified Food Grade Products, Flavors and Fragrances, I-N, Kosher Certified Products, L-M, M-N
  • {SNA} A

产品应用

  • 溶剂。气相色谱分析标准。有机合成。香料配制。

相关文献及参考

  • Beilstein: 2,IV,871
  • Short: II/27B
  • Short: II/5

安全信息

GHS Symbol
WGK Germany2
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H331 Toxic if inhaled 吸入中毒
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Hazard Codes 3
RTECSYV7750500
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241+P242+P243
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/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。
  • 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。
  • P303+P361+P353
  • P304+P340+P312
  • P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
  • P370+P378
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
UN Number 3272
Risk Statements
  • R10 Flammable 易燃
  • R20 Harmful by inhalation 吸入有害
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
  • S23 Do not breathe gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer) 不要吸入气体/烟雾/蒸汽/喷雾;
  • S36 Wear suitable protective clothing 穿戴适当的防护服;
  • 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;
  • S7/9 Keep container tightly closed and in a well-ventilated place 保持容器严格密闭,置于通风良好的场所;
  • S9 Keep container in a well-ventilated place 保持容器在通风良好的场所;
Packing GroupII
Hazard Class3
Storage condition 密封阴凉保存。 Flammables area
Warnings 危化品目录(2015) 危险化学品
TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Mammal - species unspecified
DOSE/DURATION           : 6600 mg/m3
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   GISAAA Gigiena i Sanitariya.  For English translation, see HYSAAV.  (V/O
   Mezhdunarodnaya Kniga, 113095 Moscow, USSR)  V.1-    1936-
   Volume(issue)/page/year: 51(5),61,1986

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 6600 mg/m3/2H
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single
   Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects,
   GKNT, 1982  Volume(issue)/page/year: -,88,1982

其他信息

  • 职业标准:STEL 1 毫克/ 立方米
  • 易溶于乙醇和乙醚,微溶于水。易燃。
  • 毒性分级:中毒
  • Sigma Aldrich:624-24-8(sigmaaldrich)
  • 图谱信息:戊酸甲酯(624-24-8)核磁图( 1 HNMR) 戊酸甲酯(624-24-8)Raman光谱 戊酸甲酯(624-24-8)核磁图( 13 CNMR) 戊酸甲酯(624-24-8)红外图谱(IR1) 戊酸甲酯(624-24-8)质谱(MS) 戊酸甲酯(624-24-8)红外图谱(IR2)
  • 使用限量:FEMA(mg/kg):软饮料9.1;冷饮25.0;糖果28.0;焙烤制品39.0。 FDA(§172.515,2000):适度为限。
  • TCI Shanghai:戊酸甲酯[标准物质] Methyl Valerate [Standard Material],>;99.5%(GC)(624-24-8)
  • 灭火剂:干粉、干砂、二氧化碳、泡沫
  • 类别:易燃液体
  • Acros Organics:戊酸甲酯 Methyl valerate, 99%(624-24-8)
  • 急性毒性:吸入- 小鼠 LC50: 6600 毫克/ 立方米/ 2 小时
  • 用途一:溶剂。气相色谱分析标准。有机合成。香料配制。
  • 参考质量标准:FAO/WHO,1997 含量(GT-10-4) ≥98.0% 折射率(n D 20 ) 1.393~1.399 相对密度(d 25 25 ) 0.883~0.895
  • 毒性:GRAS(FEMA)。
  • 戊酸甲酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 K9456002 戊酸甲酯 5ml 799元 2011/08/23 40034460 正戊酸甲酯 5ml 70元 2011/08/23 xp400255 戊酸甲酯 5ml 60元
  • MOL 文件:624-24-8.mol
  • 可燃性危险特性:遇明火、高温、氧化剂易燃; 燃烧产生刺激烟雾
  • Alfa Aesar:戊酸甲酯,99% Methyl valerate, 99%(624-24-8)
  • 储运特性:库房通风低温干燥; 与氧化剂、酸类分开存放
  • FEMA:2752
  • 外观性质:无色液体。
  • MSDS 信息:正戊酸甲酯(624-24-8).msds

系列性分类


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