2-(2,2-diphenylacetyl)oxyethyl-diethyl-methylazanium,bromide

Names

[ CAS No. ]:
6113-04-8

[ Name ]:
2-(2,2-diphenylacetyl)oxyethyl-diethyl-methylazanium,bromide

[Synonym ]:
Diphenylacetic acid 2-(diethylamino)ethyl ester methyl bromide
(2-(Diphenylacetoxy)ethyl)diethylmethylammonium bromide
Ammonium,diethyl(2-hydroxyethyl)methyl-,bromide,diphenylacetate
2-Diethylaminoethyl diphenylacetate methyl bromide
EINECS 228-077-8
Diaethyl-(2-diphenylacetoxy-aethyl)-methyl-ammonium,Bromid
Adiphenine methyl bromide
Lunal
Remitan
diethyl-(2-diphenylacetoxy-ethyl)-methyl-ammonium,bromide

Chemical & Physical Properties

[ Boiling Point ]:
423ºC at 760mmHg

[ Molecular Formula ]:
C21H28BrNO2

[ Molecular Weight ]:
406.35700

[ Flash Point ]:
133.2ºC

[ Exact Mass ]:
405.13000

[ PSA ]:
26.30000

[ LogP ]:
0.85210

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
BP7560000
CHEMICAL NAME :
Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, diphenylacetate
CAS REGISTRY NUMBER :
6113-04-8
LAST UPDATED :
199103
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H28-N-O2.Br
MOLECULAR WEIGHT :
406.41
WISWESSER LINE NOTATION :
2K2&1&2OVYR&R &E

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
22500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,27,1989

Safety Information

[ HS Code ]:
2923900090

Synthetic Route

Precursor & DownStream

Precursor

  • 1-(2-phenyl-tetrahydro-isoxazolo[2,3-b][1,2]oxazin-3a-yl)-ethanone
  • N,N-Diethylmethylamine
  • 2,2-Diphenylacetic acid
  • Methyl bromide
  • 2-(diethylamino)ethyl 2,2-diphenylacetate

DownStream

Customs

[ HS Code ]: 2923900090

[ Summary ]:
2923900090 other quaternary ammonium salts and hydroxides。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:6.5%。General tariff:30.0%