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77-15-6

77-15-6 structure
77-15-6 structure
  • Name: ethoheptazine
  • Chemical Name: ethyl 1-methyl-4-phenylazepane-4-carboxylate
  • CAS Number: 77-15-6
  • Molecular Formula: C16H23NO2
  • Molecular Weight: 261.35900
  • Create Date: 2018-08-22 20:43:13
  • Modify Date: 2024-01-14 12:53:02

Name ethyl 1-methyl-4-phenylazepane-4-carboxylate
Synonyms 1-Methyl-4-phenyl-hexahydro-azepin-4-carbonsaeure-aethylester
ETHOHEPTAZINE
Etoheptazina [INN-Spanish]
Zactane
Ethoheptazinum [INN-Latin]
(+-)-1-methyl-4-phenyl-hexahydro-azepine-4-carboxylic acid ethyl ester
Aethoheptazin
Ethoheptazine [BAN]
Ethyl heptazine
Density 1.037 g/cm3
Boiling Point 346.4ºC at 760 mmHg
Molecular Formula C16H23NO2
Molecular Weight 261.35900
Flash Point 114.4ºC
Exact Mass 261.17300
PSA 29.54000
LogP 2.54110
Index of Refraction 1.514

CHEMICAL IDENTIFICATION

RTECS NUMBER :
CM2800000
CHEMICAL NAME :
Azepine-4-carboxylic acid, hexahydro-1-methyl-4-phenyl-, ethyl ester
CAS REGISTRY NUMBER :
77-15-6
BEILSTEIN REFERENCE NO. :
0088192
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C16-H23-N-O2
MOLECULAR WEIGHT :
261.40
WISWESSER LINE NOTATION :
T7NTJ A1 DVO2 DR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
355 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
29ZVAB "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969 Volume(issue)/page/year: -,51,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
34 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
29ZVAB "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969 Volume(issue)/page/year: -,51,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Implant
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
277 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
29ZVAB "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969 Volume(issue)/page/year: -,51,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
318 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
29ZVAB "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969 Volume(issue)/page/year: -,51,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
65 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: 134,154,1961
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Implant
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
167 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
29ZVAB "Handbook of Analytical Toxicology," Sunshine, I., ed., Cleveland, OH, Chemical Rubber Co., 1969 Volume(issue)/page/year: -,51,1969
Precursor  0

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