1,3-Diisopropylbenzene 1,3-二异丙基苯
CAS 99-62-7 MFCD00008889
化学结构图
SMILES: CC(C)C1CCCC(C(C)C)C1
化学属性
| Mol. Formula | C12H18 |
|---|---|
| Mol. Weight | 162.27 |
| Density | 0.856 g/mL at 25 °C(lit.) |
| Refractive index | 1.4870 to 1.4910 |
| Flash Point | 76°C(lit.) |
| TSCA | Yes |
| Boiling Point | 203.2°C at 760 mmHg |
| Melting Point | -63 °C |
| Autoignition Point | 840 °F |
别名和识别编码
| Chemical Name | 1,3-Diisopropylbenzene |
|---|---|
| MDL Number | MFCD00008889 |
| CAS Number | 99-62-7 |
| Synonym | 1,3-Diisopropylbenzene {LY} 1,3-Diisopropylbenzene {} {LY} 1,3-Diisopropylbenzene {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisopropylbenzene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 1,3-Diisop |
| EC Number | 202-773-1 |
| Beilstein Registry Number | 5(4)1125 |
| PubChem Substance ID | 87568915 |
| Reaxys-RN | 1905828 |
| Chemical Name Translation | 1,3-二异丙基苯 |
| LabNetwork Molecule ID | LN00225640 |
| InChI | InChI=1S/C12H18/c1-9(2)11-6-5-7-12(8-11)10(3)4/h5-10H,1-4H3 |
| Canonical SMILES | CC(C)C1=CC(=CC=C1)C(C)C |
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分类
- {SNA} Arenes, Bioactive Small Molecules, Building Blocks, Chemical Synthesis, DIG-DY, Organic Building Blocks, 细胞生物学
- {SNA} Arenes, Building Blocks, Chemical Synthesis, Organic Building Blocks
- {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
- {SNA} Arenes, Bioactive Small Molecules, Building Blocks, Cell Biology, Chemical Synthesis, DIG-DY, Organic Building Blocks
相关文献及参考
- Short: II/27B Title: Diamagnetic Susceptibility of Organic Compounds, Oils, Paraffins and Polyethylenes Author: Kumar, M.; Gupta, R. Editor: Gupta, Radha Raman Source: Landolt-Börnstein, New Series Volume: II/27B Year: 2008 Keyword: diamagnetic susceptibility; organic compounds ISBN: 978-3-540-44359-9 (print) ISBN: 978-3-540-45860-9 (online) Internet Resource: doi:10.1007/978-3-540-45860-9 RefComment: VIII, 503 p. With CD-ROM., Hardcover RefComment: Written for: Scientists and researchers in the fields of physics, chemistry, materials science RefComment: Supplement and Revised Editon to II/16 Abstract: The volume II/27 has been divided into three subvolumes according to the classes of compounds: Subvolume A: Diamagnetic susceptibility and magnetic anisotropy of inorganic and organometallic compounds; Subvolume B: Diamagnetic susceptibility of organic compounds, oils, paraffins and polyethylenes; Subvolume C: Diamagnetic susceptibility and magnetic anisotropy of organic compounds. The data presented in this volume are based on the literature survey of the chemical abstracts up to 2005. The calculated values of diamagnetic susceptibility of organic compounds in the present subvolume II/27B are presented along with their experimental values. They have been calculated with the use of structural parameters in structural formula by using different theoretical methods available in the literature.
- Short: III/38B Title: Refractive Indices of Organic Liquids Author: Wohlfarth, Ch.; Wohlfarth, B. Editor: Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/38B Year: 1996 Keyword: organic compounds; refractive index; liquids ISBN: 3-540-60596-7 ISBN: 978-3-540-60596-6 Internet Resource: DOI:10.1007/b85533 RefComment: VII, 4210 pages, Hardcover Abstract: Volume III/38 Optical Constants provides critically evaluated data on refractive indices of inorganic and organic liquids and their wavelength dependence (dispension). Part A contains th
安全信息
- H227 Combustible liquid 可燃液体
- P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
- P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
- P273 Avoid release to the environment. 避免释放到环境中。
- 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+P350
- P302+P352+P332+P313+P362+P364
- P305+P351+P338+P337+P313
- P332+P313
- P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
- P370+P378
- P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
- P403+P235
- P501 Dispose of contents/container to..… 处理内容物/容器.....
GHS Symbol
- R33 Danger of cumulative effects 有累积作用的危险
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 3100 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,54,1982
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 7400 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,54,1982
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1650 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : 85GMAT "Toxicometric Parameters of Industrial Toxic Chemicals Under Single Exposure," Izmerov, N.F., et al., Moscow, Centre of International Projects, GKNT, 1982 Volume(issue)/page/year: -,54,1982
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Unreported SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 8630 mg/kg TOXIC EFFECTS : Peripheral Nerve and Sensation - flaccid paralysis without anesthesia (usually neuromuscular blockage) Behavioral - tremor Behavioral - excitement REFERENCE : GISAAA Gigiena i Sanitariya. For English translation, see HYSAAV. (V/O Mezhdunarodnaya Kniga, 113095
TYPE OF TEST : TCLo - Lowest published toxic concentration ROUTE OF EXPOSURE : Inhalation SPECIES OBSERVED : Rodent - rat DOSE : 200 ug/m3/5H SEX/DURATION : female 22 week(s) pre-mating TOXIC EFFECTS : Reproductive - Maternal Effects - menstrual cycle changes or disorders REFERENCE : GTPZAB Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. (V/O Mezhdunarodnaya Kniga, 113095 Moscow, USSR) V.1-36, 1957-1992. For publisher information, see MTPEEI Volume(issue)/page/year: 14(12),44,1970
其他信息
- Alfa Aesar:1,3-二异丙基苯,96% 1,3-Diisopropylbenzene, 96%(99-62-7)
- 图谱信息:1,3-二异丙基苯(99-62-7)质谱(MS) 1,3-二异丙基苯(99-62-7)红外图谱(IR1) 1,3-二异丙基苯(99-62-7)核磁图( 1 HNMR) 1,3-二异丙基苯(99-62-7)核磁图( 13 CNMR) 1,3-二异丙基苯(99-62-7)Raman光谱
- TCI Shanghai:1,3-二异基丙苯 1,3-Diisopropylbenzene,>;90.0%(GC)(99-62-7)
- 1,3-二异丙基苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D2490 1,3-二异丙基苯 1,3-Diisopropylbenzene 500ML 702元 2014/06/02 D2490 1,3-二异丙基苯 1,3-Diisopropylbenzene 25ML 151元 2014/06/02 D0927 1,3-二异丙基苯 1,3-Diisopropylbenzene 500ML 720元
- 下游产品:间苯二酚 --> 3-异丙基苯酚
- MOL 文件:99-62-7.mol
- Sigma Aldrich:99-62-7(sigmaaldrich)
