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

  • 2-(2-Chlorophenyl)-4-[1-(prop-2-yn-1-yl)piperidine-4-carbonyl]morpholine
  • 2-Azido-5-chloro-3-(4-fluorophenyl)imidazole-4-carbaldehyde
  • 2,5-Dichloro-3-(4-chlorophenyl)imidazole-4-carbaldehyde
  • 2,5-Dichloro-3-(4-fluorophenyl)imidazole-4-carbaldehyde
  • 2,5-Dichloro-3-(4-hydroxyphenyl)imidazole-4-carbaldehyde
  • Methyl 3-bromo-2-[[(1,1-dimethylethoxy)carbonyl]amino]-2-butenoate
  • N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1-(prop-2-yn-1-yl)piperidine-4-carboxamide
  • Methyl N-(tert-butoxycarbonyl)-3,3,3-trifluoro-2-phenylalaninate
  • Methyl 2-amino-2-(trifluoromethyl)pent-4-enoate
  • Methyl 3-amino-2-(4-methoxyphenyl)propanoate
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