3-Methylpent-1-En-3-Ol 3-甲基-1-戊烯-3-醇

CAS 918-85-4 MFCD00004481

化学结构图

918-85-4
SMILES: C=CC(C)(O)CC

化学属性

Mol. FormulaC6H12O
Mol. Weight100.16
Refractive indexn20/D 1.428(lit.)
Boiling Point117-118 °C(lit.)
Density0.838 g/mL at 25 °C(lit.)
Flash Point26°(79°F)
TSCAYes

别名和识别编码

Chemical Name3-Methylpent-1-En-3-Ol
Synonym 3-Methyl-1-penten-3-ol {LY} 3-Methyl-1-penten-3-ol {} {LY} 3-Methyl-1-penten-3-ol {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-penten-3-ol {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00004481
CAS Number918-85-4
PubChem Substance ID13519
EC Number213-044-2
Chemical Name Translation3-甲基-1-戊烯-3-醇
InChIKeyHFYAEUXHCMTPOL-UHFFFAOYSA-N
Wiswesser Line NotationQX2&1&1U1
Beilstein Registry Number1361621
LabNetwork Molecule IDLN00224296
InChIInChI=1S/C6H12O/c1-4-6(3,7)5-2/h4,7H,1,5H2,2-3H3
Canonical SMILESCCC(C)(O)C=C
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分类

  • {SNA} Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
  • {uni_hamburg} no charge; alcohol; racemate; 1fragment

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/8G Title: Densities of Alcohols Author: Frenkel, M.; Hong, X.; Wilhoit, R.C.; Hall, K.R. Editor: Hall, K.R.; Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8G Year: 2000 Keyword: organic compounds; density; liquids ISBN: 3-540-66233-2 ISBN: 978-3-540-66233-4 Internet Resource: DOI:10.1007/b75928 RefComment: XI, 413 pages, with CD-ROM, Hardcover
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
  • H302 Harmful if swallowed 吞食有害
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
RTECSSB3495000
Signal word Warning
Packing GroupIII
UN Number UN1987 UN 1987 3/PG 3
Risk Statements
  • R10 Flammable 易燃
  • R22 Harmful if swallowed 吞咽有害
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
  • 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；
Hazard Codes Xn
Hazard Class3 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1160 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 5,161,1955

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 700 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 115,230,1955

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1152 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 4,477,1954

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 Use explosion-proof electrical/ventilating/lighting/…/equipment. 使用防爆电气/通风/照明/ .../设备。
  • P242 Use only non-sparking tools. 只能使用无火花工具。
  • P243 Take precautionary measures against static discharge. 采取预防措施，防止静电放电。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • 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。
  • P301+P312
  • P301+P317
  • P303+P361+P353
  • P330 Rinse mouth. 漱口
  • P370+P378
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition

其他信息

  • Alfa Aesar:3-甲基-1-戊烯-3-醇,98% 3-Methyl-1-penten-3-ol, 98%(918-85-4)
  • 3-甲基-1-戊烯-3-醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2010/05/25 B20893 3-甲基-1-戊烯-3-醇, 98% 3-Methyl-1-penten-3-ol, 98% 5g 550元 2010/05/25 B20893 3-甲基-1-戊烯-3-醇, 98% 3-Methyl-1-penten-3-ol, 98% 25g 1666元
  • Sigma Aldrich:918-85-4(sigmaaldrich)
  • MOL 文件:918-85-4.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. Alkenes 烯烃
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Alkenes 烯烃
  5. Acyclic - Alkenes

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