2-Methyl-3-Hexanol 2-甲基-3-己醇

CAS 617-29-8 MFCD00004577

化学结构图

617-29-8
SMILES: CCCC(O)C(C)C

化学属性

Mol. FormulaC7H16O
Mol. Weight116.20
Density0.821 g/mL at 25 °C(lit.)
Boiling Point145°C(lit.)
Refractive index1.4200 to 1.4240
Flash Point41°C(lit.)

别名和识别编码

Chemical Name2-Methyl-3-Hexanol
MDL NumberMFCD00004577
PubChem Substance ID12040
CAS Number617-29-8
EC Number210-508-6
Reaxys-RN1719040
Beilstein Registry Number1(4)1746
Synonym 2-甲基-3-己醇 {uni_hamburg} 邻甲基间羟基二苯胺 Isopropyl-propylcarbinol 2-methyl-hexan-3-ol 2-Methyl-3-hexyl alcohol 5-Methyl-4-hexanol Isopropyl n-propyl carbinol 3-Hexanol, 2-methyl-, (±)- 2-Methyl-3-hexanol 2-methylhexan-3-ol 2-methyl-3-hydroxy-dianiline 1-Isopropyl-1-butanol NSC 91501 3-Hexanol, 2-methyl- 2-METHYL-3-HEXANOL (±)-2-Methyl-3-hexanol 2-Methylhexan-3-ol
Chemical Name Translation2-甲基-3-己醇
InChIKeyRGRUUTLDBCWYBL-UHFFFAOYSA-N
LabNetwork Molecule IDLN00241370
InChIInChI=1S/C7H16O/c1-4-5-7(8)6(2)3/h6-8H,4-5H2,1-3H3
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分类

  • {uni_hamburg} no charge; alcohol; racemate; 1fragment
  • {SNA} Alcohols, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
  • Alcohols, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds

相关文献及参考

  • Aldrich MSDS 1 , 1257:C / Corp MSDS 1 (2), 2362:A / FT-IR 2 (1), 179:C / FT-IR 1 (1), 124:C / FT-NMR 1 (1), 187:A / IR-Spectra (2), 72:C / IR-Spectra (3), 74:F / NMR-Reference 2 (1), 116:D / RegBook 1 (1), 133:M / Structure Index 1 , 16:C:2 / Vapor Phase 3 , 176:A
  • Beil. 1 ,416
  • Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
  • Short: IV/18B Title: Viscosity of Pure Organic Liquids and Binary Liquid Mixtures: Pure Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volu

安全信息

WGK Germany3
Hazard statements
  • H226 Flammable liquid and vapour 易燃液体和蒸气
GHS Symbol
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Signal word Warning {} {} {} {} {} {} {} {TCI}
UN Number 1987 UN 1987 3/PG 3
Precautionary statements
  • 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
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P370+P378
  • P241+P242+P243
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P403+P235
Risk Statements
  • R10 Flammable 易燃
Packing GroupIII
Hazard Class3
Storage condition Flammables area
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；

其他信息

  • 图谱信息:邻甲基间羟基二苯胺 (617-29-8)质谱(MS) 邻甲基间羟基二苯胺 (617-29-8)核磁图( 1 HNMR) 邻甲基间羟基二苯胺 (617-29-8)Raman光谱 邻甲基间羟基二苯胺 (617-29-8)核磁图( 13 CNMR) 邻甲基间羟基二苯胺 (617-29-8)红外图谱(IR1)
  • MOL 文件:617-29-8.mol
  • Acros Organics:2-Methyl-3-hexanol, 98%(617-29-8)
  • TCI Shanghai:2-甲基-3-己醇 2-Methyl-3-hexanol,>;96.0%(GC)(617-29-8)
  • Sigma Aldrich:617-29-8(sigmaaldrich)
  • 用途一:用于制造酸性黑染料

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. Oxygen Compounds 氧化合物
  5. Alcohols - Oxygen Compounds
  6. C7 to C8 - Alcohols

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