3,4,5-Trimethoxybenzoic acid 2-(diethylamino)ethyl ester hydrochloride

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Names

[ CAS No. ]:
4304-21-6

[ Name ]:
3,4,5-Trimethoxybenzoic acid 2-(diethylamino)ethyl ester hydrochloride

[Synonym ]:
McN-67-A-11

Chemical & Physical Properties

[ Density]:
1.076g/cm3

[ Boiling Point ]:
371.4ºC at 760 mmHg

[ Molecular Formula ]:
C16H26ClNO5

[ Molecular Weight ]:
347.83400

[ Flash Point ]:
178.4ºC

[ Exact Mass ]:
347.15000

[ PSA ]:
57.23000

[ LogP ]:
3.01300

[ Index of Refraction ]:
1.499

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DI0320000
CHEMICAL NAME :
Benzoic acid, 3,4,5-trimethoxy-, 2-(diethylamino)ethyl ester, hydrochloride
CAS REGISTRY NUMBER :
4304-21-6
LAST UPDATED :
198303
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C16-H25-N-O5.Cl-H
MOLECULAR WEIGHT :
347.88
WISWESSER LINE NOTATION :
2N2&2OVR CO1 DO1 EO1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
Standard Draize test
ROUTE OF EXPOSURE :
Administration onto the skin
SPECIES OBSERVED :
Rodent - rabbit
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962 ** ACUTE TOXICITY DATA **
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
303 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 137,410,1962

Related Compounds

  • (R)-7-Fluoro-5-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
  • 3-(9H-Fluoren-9-ylmethoxycarbonyl)-3-azabicyclo[4.1.0]heptane-7-carboxylic acid
  • 4-Chloro-2-fluoro-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyridine-3-carboxamide
  • 5-(3-Bromopropyl)-2-fluorobenzonitrile
  • Piperazine-1-carbothioamide hydrochloride
  • 3-(2,2-Difluoroethyl)oxolane-3-carbaldehyde
  • 2-cyclopropyl-1-{1-[3-(trifluoromethyl)pyridin-2-yl]azetidin-3-yl}-1H-1,3-benzodiazole
  • 2-(1-Amino-2-fluoroethyl)benzene-1,3,5-triol
  • 2-(2-Hydroxycyclopentyl)-2-methylpropanal
  • 2-Methyl-1-[(2-methyl-1,2,4-triazol-3-yl)methyl]piperidine
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