1,3-Diisopropylbenzene 1,3-二异丙基苯

CAS 99-62-7 MFCD00008889

化学结构图

99-62-7
SMILES: CC(C)C1CCCC(C(C)C)C1

化学属性

Mol. FormulaC12H18
Mol. Weight162.27
Density0.856 g/mL at 25 °C(lit.)
Refractive index1.4870 to 1.4910
Flash Point76°C(lit.)
TSCAYes
Boiling Point203.2°C at 760 mmHg
Melting Point-63 °C
Autoignition Point840 °F

别名和识别编码

Chemical Name1,3-Diisopropylbenzene
MDL NumberMFCD00008889
CAS Number99-62-7
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-Diisopropylbenzene
EC Number202-773-1
Beilstein Registry Number5(4)1125
PubChem Substance ID87568915
Reaxys-RN1905828
Chemical Name Translation1,3-二异丙基苯
LabNetwork Molecule IDLN00225640
InChIInChI=1S/C12H18/c1-9(2)11-6-5-7-12(8-11)10(3)4/h5-10H,1-4H3
Canonical SMILESCC(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

RTECSCZ6334000
WGK Germany2
Personal Protective Equipment Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) Eyeshields, Gloves, half-mask respirator (EU), half-mask respirator (US), multi-purpose combination respirator cartridge (US)
UN Number 3082 UN 3082 9/PG 3
Signal word
Hazard statements
  • H227 Combustible liquid 可燃液体
Precautionary statements
  • 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.....
Packing GroupIII
Hazard Class9
GHS Symbol
Risk Statements
  • 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

Storage condition Store at room temperature, keep dry and cool {LY} Store at room temperature, keep dry and cool {} {LY} Store at room temperature, keep dry and cool {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature, keep dry and cool {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store

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)

系列性分类

  1. Life Science 生命科学
  2. Cell Biology 细胞生物学
  3. Bioactive Small Molecules - Cell Biology
  4. DIG-DY - Bioactive Small Molecules
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Arenes 芳烃

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