1-(4-Fluoronaphthalen-1-yl)ethanone 4-氟-1-萘乙酮

CAS 316-68-7 MFCD00134475

化学结构图

316-68-7
SMILES: CC(=O)c1ccc(F)c2ccccc12

化学属性

Mol. FormulaC12H9FO
Mol. Weight188.20
Refractive indexn20/D 1.608(lit.)
Boiling Point167 °C at 17 mmHg
Density1.203 g/mL at 25 °C(lit.)
Melting Point38-39 °C
Flash Point>110°(230°F)
TSCANo

别名和识别编码

Chemical Name1-(4-Fluoronaphthalen-1-Yl)Ethanone
CAS Number316-68-7
PubChem Substance ID67568
EC Number206-261-9
MDL NumberMFCD00134475
Synonym 1-(4-Fluoronaphthalen-1-yl)ethanone {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1-(4-Fluoronaphthalen-1-yl)ethanone {} {} {} {} {} {} {} {} {}
Alfabeta NameFLUORONAPHTHYLETHANONE 141()----
Chemical Name Translation4-氟-1-萘乙酮
InChIKeyGAMOBQXCYKWQLT-UHFFFAOYSA-N
InChIInChI=1S/C12H9FO/c1-8(14)9-6-7-12(13)11-5-3-2-4-10(9)11/h2-7H,1H3
LabNetwork Molecule IDLN00184763
Canonical SMILESCC(C1=C2C=CC=CC2=C(F)C=C1)=O
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分类

  • Aryl Fluorinated Building Blocks, Building Blocks, C11 to C12, C8-C12, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Ketones, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; large ring; fused rings; 6ring; 10ring; ketone; 1fragment
  • {SNA} Aryl Fluorinated Building Blocks, Building Blocks, C11 to C12, C8-C12, Carbonyl Compounds, Chemical Synthesis, Fluorinated Building Blocks, Ketones, Organic Building Blocks, Organic Fluorinated Building Blocks, Other Fluorinated Organic Building Blocks

相关文献及参考

  • Beil. 7 ,III,1963
  • FT-NMR 1 (2), 831:B / RegBook 1 (2), 1637:D / Structure Index 1 , 257:C:1
  • 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 subvolume III/35G contains the nucleus 77Se. More nuclei will be presented later.
  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: D

安全信息

GHS Symbol
WGK Germany3
Hazard Codes Xi
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Precautionary statements
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P264+P265
  • 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。
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P317
  • P337+P317
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Warning
Risk Statements
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Safety Statements
  • S37/39 Wear suitable gloves and eye/face protection 穿戴适当的手套和眼睛/面保护；
  • 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；
  • S37 Wear suitable gloves 戴适当手套；
Warnings IRRITANT
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Halogenated 卤化物 (氟氯溴碘)
  5. Fluoro 氟化物
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C11 to C12 - Ketones

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