Cyclopropyl ketone, oxime 二环丙基甲酮肟
CAS 1453-52-7 MFCD00019255
化学结构图
SMILES: ON=C(C1CC1)C1CC1
化学属性
| Mol. Formula | C7H11NO |
|---|---|
| Mol. Weight | 125.17 |
| Melting Point | 67 °C |
| Boiling Point | 246.1±7.0 °C at 760 mmHg |
别名和识别编码
| Chemical Name | Cyclopropyl ketone, oxime |
|---|---|
| Synonym | Dicyclopropylmethanone oxime {LY} Dicyclopropylmethanone oxime {} {LY} Dicyclopropylmethanone oxime {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone oxime {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Dicyclopropylmethanone ox |
| Wiswesser Line Notation | L3TJ AYUNQ- AL3TJ |
| CAS Number | 1453-52-7 |
| Beilstein Registry Number | 1931116 |
| InChIKey | AEVSLBGUEKOQEE-UHFFFAOYSA-N |
| Chemical Name Translation | 二环丙基甲酮肟 |
| PubChem Substance ID | 15072 |
| InChI | InChI=1S/C7H11NO/c9-8-7(5-1-2-5)6-3-4-6/h5-6,9H,1-4H2 |
| Canonical SMILES | ON=C(C1CC1)C2CC2 |
| MDL Number | MFCD00019255 |
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分类
- {uni_hamburg} no charge; carbocycle; alicycle; 3ring; 1fragment
相关文献及参考
- 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.
- Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15
安全信息
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 440 mg/kg TOXIC EFFECTS : Autonomic Nervous System - smooth muscle relaxant (mechanism undefined, spasmolytic) Behavioral - changes in motor activity (specific assay) REFERENCE : PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 12,227,1978
- H302 Harmful if swallowed 吞食有害
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- 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。
- P301+P312
- P301+P317
- P330 Rinse mouth. 漱口
- P501 Dispose of contents/container to..… 处理内容物/容器.....
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