2-Methylbenzyl alcohol 邻甲基苯甲醇

CAS 89-95-2 MFCD00004622

化学结构图

89-95-2
SMILES: Cc1ccccc1CO

化学属性

Mol. FormulaC8H10O
Mol. Weight122.16
Refractive indexn20/D 1.5408(lit.)
Boiling Point218.4°C at 760 mmHg
Melting Point33-36 °C
Density1.422
Flash Point104°(219°F)
TSCANo
Vapor Pressure0.75 mmHg ( 86 °C)
Appearance 白色结晶体，熔点 39℃，沸点 109-110℃，闪点 104℃
Solubilitymethanol: 0.1 g/mL, clear

别名和识别编码

Chemical Nameo-Tolylmethanol
CAS Number89-95-2
PubChem Substance ID6994
EC Number201-954-2
Beilstein Registry Number1929783
MDL NumberMFCD00004622
Reaxys-RN1929783
Synonym 2-Methylbenzyl alcohol {LY} 2-Methylbenzyl alcohol 2-methylbenzyl alcohol 2-methylbenzyl alcohol, 3H-labeled ortho-methylbenzyl alcohol {} {LY} 2-Methylbenzyl alcohol {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylbenzyl alcohol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Chemical Name Translation邻甲基苯甲醇
LabNetwork Molecule IDLN00222606
InChIInChI=1S/C8H10O/c1-7-4-2-3-5-8(7)6-9/h2-5,9H,6H2,1H3
Canonical SMILESCC1=CC=CC=C1CO
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分类

  • {SNA} Alcohols, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; alcohol; 1fragment
  • Alcohols, Building Blocks, C7 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds

相关文献及参考

  • Beil. 6 ,IV,3109
  • Aldrich MSDS 1 , 1212:D / Corp MSDS 1 (2), 2299:C / FT-IR 1 (1), 1126:C / FT-IR 2 (2), 1923:B / FT-NMR 1 (2), 339:B / IR-Spectra (3), 677:E / NMR-Reference 2 (1), 931:A / RegBook 1 (1), 1321:B / Structure Index 1 , 202:A:4 / Vapor Phase 3 , 1051:A
  • Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR) Data is therefore of major interest to all scientists and engineers who intend to use NMR to study the structure and the binding of molecules. Volume III/35 "NMR-Data" is divided into several subvolumes and parts. Subvolume III/35A contains the nuclei 11B and 31P, subvolume III/35B contains the nuclei 19F and 15N, subvolume III/35C contains the nucleus 1H, subvolume III/35D contains the nucleus 13C, subvolume III/35E contains the nucleus 17O, and

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H318 Causes serious eye damage 严重伤害眼睛
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xi,Xn Xn Xi
Precautionary statements
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • 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
  • P305+P351+P338
  • P305+P354+P338
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P317
  • P330 Rinse mouth. 漱口
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • S24/25 Avoid contact with skin and eyes 避免皮肤和眼睛接触；
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后，立即用大量水冲洗并征求医生意见；
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护；
  • S37 Wear suitable gloves 戴适当手套；
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • S39 Wear eye/face protection 戴眼睛/面孔保护装置；
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {}

其他信息

  • MSDS 信息:2-Methylbenzyl alcohol(89-95-2).msds
  • 下游产品:2-甲基-3-苯基苯甲醇
  • 邻甲基苄醇价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M0887 2-甲基苄醇 2-Methylbenzyl Alcohol 25G 349元 2010/05/25 A12696 2-甲基苯甲醇, 98% 2-Methylbenzyl alcohol, 98% 50g 760元 2010/05/25 A12696 2-甲基苯甲醇, 98% 2-Methylbenzyl alcohol, 98% 250g 3038元
  • 蒸气压:0.75 mm Hg ( 86 °C)
  • Sigma Aldrich:89-95-2(sigmaaldrich)
  • 海关编码:29339990
  • 图谱信息:邻甲基苄醇(89-95-2)红外图谱(IR1) 邻甲基苄醇(89-95-2)质谱(MS) 邻甲基苄醇(89-95-2)核磁图( 1 HNMR) 邻甲基苄醇(89-95-2)核磁图( 13 CNMR) 邻甲基苄醇(89-95-2)红外图谱(IR2) 邻甲基苄醇(89-95-2)Raman光谱 邻甲基苄醇(89-95-2)红外图谱(IR3)
  • MOL 文件:89-95-2.mol
  • Alfa Aesar:2-甲基苯甲醇,98% 2-Methylbenzyl alcohol, 98%(89-95-2)
  • TCI Shanghai:2-甲基苄醇 2-Methylbenzyl Alcohol,>;97.0%(GC)(89-95-2)
  • Acros Organics:2-甲基苄醇 2-Methylbenzyl alcohol, 98%(89-95-2)

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
  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. Aromatic alcohols 芳香醇