Choline 2,6-xylyl ether bromide

CAS 669-49-8 MFCD01669860

化学结构图

669-49-8
SMILES: Cc1cccc(C)c1OCC[N+](C)(C)C.[Br-]

化学属性

Mol. FormulaC13H22NO.Br
Mol. Weight288.27

别名和识别编码

Chemical NameAmmonium, trimethyl(2-(2,6-xylyloxy)ethyl)-, bromide
Synonym 2,6-Xylyl ether bromide Choline 2,6-xylyl ether bromide Ethanaminium, 2-(2,6-dimethylphenoxy)-N,N,N-trimethyl-, bromide N,N,N-trimethyl-(2-(2,6-xylyloxy)ethyl)ammonium TM 10 Trimethyl(2-(2,6-xylyloxy)ethyl)ammonium bromide Xylocholine Xylocholine bromide beta-TM-10 xylocholine xylocholine bromide xylocholine chloride xylocholine ether xylocholine iodide
Wiswesser Line Notation1K1&1&2OR B1 F1 &Q &E
CAS Number669-49-8
InChIKeyZFHWDLYDBITDJK-UHFFFAOYSA-M
PubChem Substance ID12633
InChIInChI=1S/C13H22NO.BrH/c1-11-7-6-8-12(2)13(11)15-10-9-14(3,4)5;/h6-8H,9-10H2,1-5H3;1H/q+1;/p-1
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分类

  • {uni_hamburg}

相关文献及参考

  • Short: III/10a Title: Structure Data of Organic Crystals: C ... C 15 Author: Schudt-Weitz, G.; Strell, I. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/10a Year: 1985 ISBN: 3-540-07834-7 ISBN: 978-3-540-07834-0 Internet Resource: DOI:10.1007/b19984 RefComment: XXII, 634 pages. Hardcover Abstract: The volume includes an alphabetical index of all substances and a separate "ring index" with all cyclic compounds.

安全信息

RTECSBT4200000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 8500 ug/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - muscle weakness
   Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 12,312,1957

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 95 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 9,471,1954

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 240 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - muscle weakness
   Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 12,312,1957

系列性分类

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