1-Hexen-3-OL 1-己烯-3-醇

CAS 4798-44-1 MFCD00004581

化学结构图

4798-44-1
SMILES: C=CC(O)CCC

化学属性

Mol. FormulaC6H12O
Mol. Weight100.16
Density0.834 g/mL at 25 °C(lit.)
Refractive index1.4270 to 1.4300
Flash Point35°C(lit.)
TSCAYes
Boiling Point134-135 °C at 760 mmHg
Solubility不溶
Melting Point22.55 °C

别名和识别编码

Chemical Name1-Hexen-3-OL
Synonym Hex-1-en-3-ol {LY} Hex-1-en-3-ol {} {LY} Hex-1-en-3-ol {} {} {LY} Hex-1-en-3-ol {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Hex-1-en-3-ol
MDL NumberMFCD00004581
CAS Number4798-44-1
EC Number225-355-0
Beilstein Registry Number1(2)485
PubChem Substance ID20928
Reaxys-RN1720166
Chemical Name Translation1-己烯-3-醇
InChIKeyBVOSSZSHBZQJOI-UHFFFAOYSA-N
LabNetwork Molecule IDLN01359907
InChIInChI=1S/C6H12O/c1-3-5-6(7)4-2/h4,6-7H,2-3,5H2,1H3
Canonical SMILESCCCC(C=C)O
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分类

  • {SNA} Acyclic, Alkenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
  • {uni_hamburg} no charge; alcohol; racemate; 1fragment
  • {SNA} A-D, Alphabetical Listings, Flavors and Fragrances, G-H, Halal Certified Products, K
  • {SNA} A-D, Alphabetical Listings, E - H, Flavors and Fragrances, G-H, Halal Certified Products, Kosher Certified Products
  • {SNA} A-D, Alphabetical Listings, Certified Food Grade Products, E - H, Flavors and Fragrances, G-H, H-J, Halal Certified Products, 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: III/47 Title: Optical Constants: Refractive Indices of Pure Liquids and Binary Liquid Mixtures Author: Wohlfarth, Ch. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/47 Year: 2008 Keyword: binary liquid mixtures; inorganic liquid; optical constant; organic liquid; organoarsenic liquid; organoboron liquid; organometallic liquid; organophosphorus liquid; organosilicon liquid; organovanadic liquid; pure liquids; refractive index ISBN: 978-3-540-75289-9 (Print) ISBN: 978-3-540-75291-2 (Online) Internet Resource: DOI:10.1007/978-3-540-75291-2 RefComment: VII, 298 p., Hardcover RefComment: Written for scientists and engineers in the fields of physics, chemistry, and physical chemistry Abstract: This Landolt-Börnstein volume III/47 is a supplement to the volumes III/38 A/B "Optical Constants" and provides refractive index data published in the years 1995-2006. Included in this volume are refractive indices of inorganic, organometallic, organononmetallic, and organic liquids as well as their binary liquid mixtures at different wavelengths, temperatures, and pressures. Not all published data could be included in the printed version, but the electronic version contains

安全信息

Packing GroupIII
UN Number 1987 UN 1987 3/PG 3 UN1987
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；
  • S29 Do not empty into drains 不要排入下水道；
  • S33 Take precautionary measures against static discharges 对静电采取预防措施；
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
Signal word Warning
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。
  • P241+P242+P243
  • 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.....
Hazard Class3
Storage condition

其他信息

  • 用途一:用作医药中间体，也可作为香料
  • 图谱信息:1-己烯-3-醇(4798-44-1)核磁图( 13 CNMR) 1-己烯-3-醇(4798-44-1)质谱(MS) 1-己烯-3-醇(4798-44-1)红外图谱(IR1) 1-己烯-3-醇(4798-44-1)Raman光谱 1-己烯-3-醇(4798-44-1)核磁图( 1 HNMR)
  • Alfa Aesar:1-己烯-3-醇,98% 1-Hexen-3-ol, 98%(4798-44-1)
  • MOL 文件:4798-44-1.mol
  • MSDS 信息:1-Hexen-3-ol(4798-44-1).msds
  • TCI Shanghai:1-己烯-3-醇 1-Hexen-3-ol,>;95.0%(GC)(4798-44-1)
  • 1-己烯-3-醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 H0659 1-己烯-3-醇 1-Hexen-3-ol 25ML 824元 2010/05/25 A19672 1-己烯-3-醇, 98% 1-Hexen-3-ol, 98% 50g 2534元 2010/05/25 A19672 1-己烯-3-醇, 98% 1-Hexen-3-ol, 98% 10g 636元
  • Sigma Aldrich:4798-44-1(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） 1-己烯-3-醇 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
  • FEMA:3608

系列性分类

  1. Chemical Synthesis 化学合成
  2. Catalysis and Inorganic Chemistry 催化剂和无机化学
  3. Calcium - Catalysis and Inorganic Chemistry
  1. Application Areas 应用领域分类
  2. Flavors and Fragrances 香精香料
  3. Kosher Certified Products - Flavors and Fragrances
  4. E-H - Kosher Certified Products
  1. Application Areas 应用领域分类
  2. Flavors and Fragrances 香精香料
  3. Alphabetical Listings - Flavors and Fragrances
  4. G-H - Alphabetical Listings
  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
  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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