Product Name

  • Name

    [2-[hydroxydiphenylacetoxy]ethyl]dimethyloctylammonium bromide

  • EINECS
  • CAS No. 2019-14-9
  • Density g/cm3
  • Solubility
  • Melting Point
  • Formula C26H38 N O3 . Br
  • Boiling Point °Cat760mmHg
  • Molecular Weight 492.56
  • Flash Point °C
  • Transport Information
  • Appearance
  • Safety Poison by intraperitoneal and intravenous routes. Moderately toxic by ingestion and subcutaneous routes. When heated to decomposition it emits very toxic fumes of NOx, NH3, and Br−.
  • Risk Codes
  • Molecular Structure Molecular Structure of 2019-14-9 ([2-[hydroxydiphenylacetoxy]ethyl]dimethyloctylammonium bromide)
  • Hazard Symbols
  • Synonyms (2-Hydroxyethyl)dimethyloctylammoniumbromide, benzilate (6CI,7CI); 1-Octanaminium,N-[2-[(hydroxydiphenylacetyl)oxy]ethyl]-N,N-dimethyl-, bromide (9CI); Ammonium,(2-hydroxyethyl)dimethyloctyl-, bromide, benzilate (8CI); Benzilic acid, esterwith (2-hydroxyethyl)dimethyloctylammonium bromide; N,N-Dimethyl-N-n-octyl-N-(b-diethyl benzilate)ammoniumbromide
  • PSA
  • LogP

Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate Chemical Properties

Molecule structure of Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate (CAS NO.2019-14-9) :

IUPAC Name: 2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl-dimethyl-octylazanium bromide 
Molecular Weight: 492.48882 g/mol
Molecular Formula: C26H38BrNO3
H-Bond Donor: 1
H-Bond Acceptor: 4
Rotatable Bond Count: 14
Exact Mass: 491.203507
MonoIsotopic Mass: 491.203507
Topological Polar Surface Area: 46.5
Heavy Atom Count: 31
Complexity: 461
Canonical SMILES: CCCCCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]
InChI: InChI=1S/C26H38NO3.BrH/c1-4-5-6-7-8-15-20-27(2,3)21-22-30-25(28)26(29,23-16-11-9-12-17-23)24-18-13-10-14-19-24;/h9-14,16-19,29H,4-8,15,20-22H2,1-3H3;1H/q+1;/p-1
InChIKey of Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate (CAS NO.2019-14-9) : JVFBRWHIOQXBFW-UHFFFAOYSA-M

Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate Toxicity Data With Reference

1.    

orl-mus LD50:1150 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 5 (1963),225.
2.    

ipr-mus LD50:104 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 5 (1963),225.
3.    

scu-mus LD50:850 mg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 5 (1963),225.
4.    

ivn-mus LD50:17,500 µg/kg

     TXAPA9    Toxicology and Applied Pharmacology. 5 (1963),225.

Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate Safety Profile

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

Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate Specification

 Dimethyl(2-hydroxyethyl)octyl-ammonium bromide benzilate (CAS NO.2019-14-9) is also called (2-Benziloxyethyl) imethyloctylammonium bromide ; Benzilsaeure-dimethyl-octyl-ammonium-aethylester bromide ; Benzilsaeure-dimethyl-octyl-ammonium-aethylester bromide [German] ; (2-(Hydroxydiphenylacetoxy)ethyl)dimethyloctylammonium bromide ; Ammonium, dimethyl(2-hydroxyethyl)octyl-, bromide, benzilate .

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