Pentachlorobenzoic acid 2,3,4,5,6-pentachloro-benzoic acid

CAS 1012-84-6 MFCD00092425

化学结构图

1012-84-6
SMILES: O=C(O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl

化学属性

Mol. FormulaC7HCl5O2
Mol. Weight294.35
Melting Point209.3 °C

别名和识别编码

Chemical Name2,3,4,5,6-Pentachloro-benzoic acid
Synonym 2,3,4,5,6-Pentachlorobenzoic acid {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,4,5,6-Pentachlorobenzoic acid {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
InChIKeyIONYGGJUUJFXJK-UHFFFAOYSA-N
Wiswesser Line NotationQVR BG CG DG EG FG
CAS Number1012-84-6
Beilstein Registry Number0986504
LabNetwork Molecule IDLN01111957
PubChem Substance ID13896
InChIInChI=1S/C7HCl5O2/c8-2-1(7(13)14)3(9)5(11)6(12)4(2)10/h(H,13,14)
Chemical Name Translation2,3,4,5,6-pentachloro-benzoic acid
Canonical SMILESC1(=C(C(=C(C(=C1Cl)Cl)Cl)Cl)Cl)C(=O)O
MDL NumberMFCD00092425
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carboxylic acid; 1fragment

相关文献及参考

  • Short: III/20b Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei Cl ... Rb Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20b Year: 1988 Keyword: NQR ISBN: 3-540-18483-X ISBN: 978-3-540-18483-6 Internet Resource: DOI:10.1007/b86664 RefComment: IX,717 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 branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.

安全信息

RTECSDH6190000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 178 mg/kg
TOXIC EFFECTS :
   Behavioral - rigidity (including catalepsy)
   Behavioral - muscle contraction or spasticity
REFERENCE :
   JMCMAR Journal of Medicinal Chemistry.  (American Chemical Soc.,
   Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC
   20037)  V.6-    1963-  Volume(issue)/page/year: 11,1020,1968

Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • H413 Maycauselonglastingharmfuleffectstoaquaticlife 可能对水生生物造成长期持续有害影响。
Precautionary statements
  • 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。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P301+P310
  • P301+P316
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Storage condition

系列性分类

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