Xanthene 氧杂蒽

CAS 92-83-1 MFCD00005055

化学结构图

92-83-1
SMILES: c1ccc2c(c1)Cc1ccccc1O2

化学属性

Mol. FormulaC13H10O
Mol. Weight182.22
Boiling Point310 - 312 C
Melting Point101-102 °C
Solubility可溶
Density1.042
Appearance 无色片状晶体。 不溶于水,溶于乙醚、氯仿、苯和石油醚。溶于浓硫酸为黄色溶液。

别名和识别编码

Chemical NameXanthene
MDL NumberMFCD00005055
CAS Number92-83-1
Synonym 9H-Xanthene {LY} 9H-Xanthene {} {LY} 9H-Xanthene {} {} {LY} 9H-Xanthene {} {} {} {LY} 9H-Xanthene {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 9H-Xanthene {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
PubChem Substance ID87577873
EC Number202-194-4
Beilstein Registry Number17,73
Reaxys-RN133939
Chemical Name Translation氧杂蒽
InChIKeyGJCOSYZMQJWQCA-UHFFFAOYSA-N
Wiswesser Line NotationT C666 BO IHJ
LabNetwork Molecule IDLN01104437
Canonical SMILESC1C2=CC=CC=C2OC2=CC=CC=C12
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分类

  • {uni_hamburg} no charge; oxygen heterocycle; carbocycle; aromatic; alicycle; large ring; fused rings; 6ring; 10ring; 14ring; ether; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, O-Containing, Others
  • {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, O-Containing, Other Heterocyclic Building Blocks

相关文献及参考

  • Short: II/25D Title: Structure Data of Free Polyatomic Molecules: Molecules Containing Five or More Carbon Atoms Author: Graner, G.; Hirota, E.; Iijima, T.; Kuchitsu, K.; Ramsay, D.A.; Vogt, J.; Vogt, N. Editor: Kuchitsu, K. Source: Landolt-Börnstein, New Series Volume: II/25D Year: 2003 Keyword: Free Polyatomic Molecules; Carbon Atoms; Molecules ISBN: 3-540-42860-7 ISBN: 978-3-540-42860-2 Internet Resource: DOI:10.1007/b75952 RefComment: VIII, 569 pages. Hardcover RefComment: Written for scientists and researchers in the fields of chemistry and physics Abstract: This fourth subvolume presents data on the geometric parameters (internuclear distances, bond angles, dihedral angles of internal rotation etc) of free polyatomic molecules including free radicals and molecular ions. The survey on structure data consists of four subvolumes, each containing the geometric parameters determined in the gas phase either by an analysis of the rotational constants (and sometimes the vibrational constants) obtained from microwave, infrared, Raman, electronic and photoelectron spectroscopy or by an analysis of electron diffraction intensities. Most of the structures listed in the tables are for molecules in the electronic ground state, but structures for electronically excited states have also been included as far as they are available. In this fourth subvolume, the structure of molecules containing five to sixty carbon atoms is listed.
  • Short: III/20a Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cl Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20a Year: 1988 Keyword: NQR ISBN: 3-540-18161-X ISBN: 978-3-540-18161-3 Internet Resource: DOI:10.1007/b31153 RefComment: IX,677 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different br

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
RTECSZD5520000
Precautionary statements
  • P304+P340+P342+P311
  • P285 In case of inadequate ventilation wear respiratory protection. 在通风不足的情况下,戴呼吸防护。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P302+P352+P333+P313+P362+P364
  • 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。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P333+P313
  • P304+P341
  • P302+P350
  • P342+P311
Signal word Warning
Hazard Codes Xn
Safety Statements
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
  • S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套;
  • S24 Avoid contact with skin 避免皮肤接触;
  • S22 Do not breathe dust 不要吸入粉尘;
Risk Statements
  • R42/43
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 690 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 8,107,1958

Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {

其他信息

  • 用途一:用作有机合成试剂,用于合成染料等
  • 检测方法:NMR,GC
  • MOL 文件:92-83-1.mol
  • TCI Shanghai:or 氧杂蒽 Xanthene,>;98.0%(GC)(92-83-1)
  • Sigma Aldrich:92-83-1(sigmaaldrich)
  • 海关编码:29181100
  • 图谱信息:氧杂蒽(92-83-1)核磁图( 13 CNMR) 氧杂蒽(92-83-1)红外图谱(IR1) 氧杂蒽(92-83-1)质谱(MS) 氧杂蒽(92-83-1)核磁图( 1 HNMR) 氧杂蒽(92-83-1)红外图谱(IR2)
  • 氧杂蒽价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 X0003 氧杂蒽 Xanthene 25G 919元 2010/06/21 140951000 氧杂蒽 Xanthene 98% 100 GR 2546元 2010/06/21 140950050 氧杂蒽 Xanthene 98% 5 GR 278元
  • 下游产品:呫吨-9-羧酸
  • MSDS 信息:Xanthene(92-83-1).msds
  • 上游原料:氢氧化钠 --> 乙醚 --> 苯酚 --> 五氧化二磷 --> 水杨醇
  • Acros Organics:氧杂蒽/呫吨 Xanthene, 98%(92-83-1)

系列性分类


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