1,4-Dioxaspiro[4.5]Decane 1,4-二氧螺环[4,5]癸烷
CAS 177-10-6 MFCD00005409
化学结构图
SMILES: C1CCC2(CC1)OCCO2
化学属性
| Mol. Formula | C8H14O2 |
|---|---|
| Mol. Weight | 142.20 |
| Density | 1.028 g/mL at 25 °C(lit.) |
| Boiling Point | 184°C at 760 mmHg |
| Refractive index | n20/D 1.459(lit.) |
| Melting Point | 176-180 °C |
| Flash Point | 68°C |
别名和识别编码
| Chemical Name | 1,4-Dioxaspiro[4.5]Decane |
|---|---|
| Synonym | 1,4-Dioxaspiro[4.5]decane {LY} 1,4-Dioxaspiro[4.5]decane {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,4-Dioxaspiro[4.5]decane {} {} {} {} {} {} {} {} {} {} |
| MDL Number | MFCD00005409 |
| PubChem Substance ID | 9093 |
| EC Number | 205-867-0 |
| Chemical Name Translation | 1,4-二氧螺环[4,5]癸烷 |
| InChIKey | GZGPRZYZKBQPBQ-UHFFFAOYSA-N |
| Wiswesser Line Notation | T5OXOTJ B-& AL6XTJ |
| CAS Number | 177-10-6 |
| Beilstein Registry Number | 0104573 |
| LabNetwork Molecule ID | LN01363358 |
| InChI | InChI=1S/C8H14O2/c1-2-4-8(5-3-1)9-6-7-10-8/h1-7H2 |
| Canonical SMILES | C1CCC2(CC1)OCCO2 |
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分类
- {uni_hamburg} no charge; oxygen heterocycle; carbocycle; alicycle; fused rings; 5ring; 6ring; spiro; acetal; 1fragment
- {SNA} Acetals/Ketals/Ortho Esters, Building Blocks, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds
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 : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 500 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 8,740,1956
