2-Methylcyclohexane-1,3-dione 2-甲基环己烷-1,3-二酮
CAS 1193-55-1 MFCD00001587
化学结构图
SMILES: CC1C(=O)CCCC1=O
化学属性
| Mol. Formula | C7H10O2 |
|---|---|
| Mol. Weight | 126.15 |
| Melting Point | 206-208°C |
| TSCA | No |
| Solubility | 不溶 |
| Boiling Point | 235.7°C at 760 mmHg |
别名和识别编码
| Chemical Name | 2-Methylcyclohexane-1,3-dione |
|---|---|
| Beilstein Registry Number | 7(4)1992 |
| PubChem Substance ID | 70945 |
| CAS Number | 1193-55-1 |
| EC Number | 214-773-9 |
| MDL Number | MFCD00001587 |
| Reaxys-RN | 1281598 |
| Synonym | 2-Methylcyclohexane-1,3-dione {LY} 2-Methylcyclohexane-1,3-dione {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1,3-dione {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Methylcyclohexane-1 |
| Chemical Name Translation | 2-甲基环己烷-1,3-二酮 |
| InChIKey | VSGJHHIAMHUZKF-UHFFFAOYSA-N |
| LabNetwork Molecule ID | LN00221632 |
| InChI | InChI=1S/C7H10O2/c1-5-6(8)3-2-4-7(5)9/h5H,2-4H2,1H3 |
| Canonical SMILES | O=C1C(C)C(CCC1)=O |
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分类
- {SNA} Bioactive Small Molecules, Building Blocks, C7 to C8,
- Bioactive Small Molecules, Building Blocks, C7 to C8, Carbonyl Compounds, Cell Biology, Chemical Synthesis, Ketones, M, Organic Building Blocks
- {SNA} Building Blocks, C7 to C8, Carbonyl
相关文献及参考
- 1. J. Org. Chem. 58 , 2972, (1993)
- Beil. 7 ,IV,1992
- Corp MSDS 1 (2), 2323:A / FT-IR 2 (1), 706:B / FT-IR 1 (1), 427:D / FT-NMR 1 (1), 702:C / IR-Spectra (2), 227:A / IR-Spectra (3), 253:E / NMR-Reference 2 (1), 391:A / RegBook 1 (1), 487:F / Sigma FT-IR 1 (2), 726:C / Structure Index 1 , 70:B:1
- Useful building block for ring B of the steroid nucleus: J. Am. Chem. Soc., 79, 5542 (1957); J. Chem. Soc., 3441 (1957); Helv. Chim. Acta, 36, 482 (1953). For C-methylation using MeI and Benzyltrimethylammonium hydroxide, A14927, see: Org. Synth. Coll., 8, 312 (1993).
安全信息
GHS Symbol
其他信息
- Alfa Aesar:2-甲基环己烷-1,3-二酮,98+% 2-Methylcyclohexane-1,3-dione, 98+%(1193-55-1)
- 海关编码:29142900
- 图谱信息:2-甲基-1,3-环己二酮(1193-55-1)红外图谱(IR2) 2-甲基-1,3-环己二酮(1193-55-1)红外图谱(IR1) 2-甲基-1,3-环己二酮(1193-55-1)Raman光谱 2-甲基-1,3-环己二酮(1193-55-1)核磁图( 1 HNMR) 2-甲基-1,3-环己二酮(1193-55-1)核磁图( 13 CNMR) 2-甲基-1,3-环己二酮(1193-55-1)质谱(MS)
- Sigma Aldrich:1193-55-1(sigmaaldrich)
- Acros Organics:2-甲基-1,3-环已二酮 2-Methyl-1,3-cyclohexanedione, 98+%(1193-55-1)
- F:3-10
- 2-甲基-1,3-环己二酮价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M1133 2-甲基-1,3-环己二酮 2-Methyl-1,3-cyclohexanedione 25G 709元 2014/06/02 M1133 2-甲基-1,3-环己二酮 2-Methyl-1,3-cyclohexanedione 5G 215元 2010/06/21 126590250 2-甲基-1,3-环己二酮 2-Methyl-1,3-cyclohexanedione 98+% 25 GR 1013元
- 敏感性:Hygroscopic
- MOL 文件:1193-55-1.mol
- TCI Shanghai:2-甲基-1,3-环己二酮 2-Methyl-1,3-cyclohexanedione,>;98.0%(T)(1193-55-1)
- MSDS 信息:2-Methyl-1,3-cyclohexanedione(1193-55-1).msds
