3-Methyl-2,3-Dihydro-1H-Inden-1-One 3-甲基-1-茚酮

CAS 6072-57-7 MFCD00156725

化学结构图

6072-57-7
SMILES: CC1CC(=O)c2ccccc21

化学属性

Mol. FormulaC10H10O
Mol. Weight146.19
Density1.075 g/mL at 25 °C(lit.)
Boiling Point226.7 °C at 760 mmHg
Refractive indexn20/D 1.558(lit.)
Flash Point>;230 °F

别名和识别编码

Chemical Name3-Methyl-2,3-Dihydro-1H-Inden-1-One
CAS Number6072-57-7
Alfabeta NameMETHYLINDANONE 31----
MDL NumberMFCD00156725
PubChem Substance ID259560
Synonym 3-Methyl-2,3-dihydro-1H-inden-1-one {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihydro-1H-inden-1-one {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-2,3-dihy
Chemical Name Translation3-甲基-1-茚酮
InChIKeyXVTQSYKCADSUHN-UHFFFAOYSA-N
LabNetwork Molecule IDLN00162428
InChIInChI=1S/C10H10O/c1-7-6-10(11)9-5-3-2-4-8(7)9/h2-5,7H,6H2,1H3
Canonical SMILESCC1CC(=O)C2=CC=CC=C12
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分类

  • {SNA} Building Blocks, C10, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • Building Blocks, C10, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; alicycle; large ring; fused rings; 5ring; 6ring; 9ring; ketone; racemate; 1fragment

相关文献及参考

  • Beil. 7 ,IV,1019
  • FT-IR 2 (2), 2373:B / RegBook 1 (2), 1625:H / Structure Index 1 , 254:A:3
  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.

安全信息

Warnings IRRITANT
WGK Germany3
Personal Protective Equipment Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
Hazard Codes Xn
Safety Statements
  • S22 Do not breathe dust 不要吸入粉尘；
  • 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；
  • 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；
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
  • R22 Harmful if swallowed 吞咽有害
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 {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

  • MOL 文件:6072-57-7.mol
  • Acros Organics:3-methylindan-1-one(6072-57-7)
  • Sigma Aldrich:6072-57-7(sigmaaldrich)

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. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C10 - Ketones

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