Product Name

  • Name

    N,N-diethyl-3-hydroxy-N-methylanilinium bromide

  • EINECS
  • CAS No. 27068-06-0
  • Density g/cm3
  • Solubility
  • Melting Point
  • Formula C11H18 N O . Br
  • Boiling Point °Cat760mmHg
  • Molecular Weight 260.21
  • Flash Point °C
  • Transport Information
  • Appearance
  • Safety Poison by intraperitoneal, subcutaneous, and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NH3, NOx, and Br−. See also BROMIDES.
  • Risk Codes
  • Molecular Structure Molecular Structure of 27068-06-0 (N,N-diethyl-3-hydroxy-N-methylanilinium bromide)
  • Hazard Symbols
  • Synonyms Ammonium,diethyl(m-hydroxyphenyl)methyl-, bromide (8CI); Benzenaminium,N,N-diethyl-3-hydroxy-N-methyl-, bromide (9CI);3-Hydroxyphenyldiethylmethylammonium bromide
  • PSA
  • LogP

Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide Chemical Properties

Molecular Structure of Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide (CAS NO. 27068-06-0):

IUPAC Name: Diethyl-(3-hydroxyphenyl)-methylazanium bromide 
Molecular Formula: C11H18BrNO
Molecular Weight: 260.170720 g/mol
H-Bond Donor: 1
H-Bond Acceptor: 2
Freely Rotating Bonds: 4
Canonical SMILES: CC[N+](C)(CC)C1=CC(=CC=C1)O.[Br-]
InChI: InChI=1S/C11H17NO.BrH/c1-4-12(3,5-2)10-7-6-8-11(13)9-10;/h6-9H,4-5H2,1-3H3;1H
InChIKey: FPSGOTBPWRPBCZ-UHFFFAOYSA-N
Polar Surface Area of Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide (CAS NO. 27068-06-0): 9.23 Å2

Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide Toxicity Data With Reference

1.    

orl-mus LD50:690 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 100 (1950),83.
2.    

ipr-mus LD50:26 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 100 (1950),83.
3.    

scu-mus LD50:61 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 100 (1950),83.
4.    

ivn-mus LD50:10 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 100 (1950),83.
5.    

ivn-dog LD50:20 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 100 (1950),83.
6.    

ivn-rbt LD50:27 mg/kg

     JPETAB    Journal of Pharmacology and Experimental Therapeutics. 100 (1950),83.

Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide Safety Profile

Poison by intraperitoneal, subcutaneous, and intravenous routes. Moderately toxic by ingestion. When heated to decomposition it emits very toxic fumes of NH3, NOx, and Br−. See also BROMIDES.

Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide Specification

  Ammonium, diethyl(m-hydroxyphenyl)methyl-, bromide with cas registry number of 27068-06-0 is also called for (3-Hydroxyphenyl)diethylmethylammonium bromide ; Diethyl(m-hydroxyphenyl)methylammonium bromide ; Ro 2-2980 .

Related Products

Hot Products

Post buying leads

About|Contact|Cas|Product Name|Molecular|Country|Encyclopedia

Message|New Cas|MSDS|Service|Advertisement|CAS DataBase|Article Data|Manufacturers | Chemical Catalog

©2008 LookChem.com,License: ICP

NO.:Zhejiang16009103

complaints:service@lookchem.com Desktop View