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5626-16-4

5626-16-4 structure
5626-16-4 structure
  • Name: Didesmethyldoxepin
  • Chemical Name: (3Z)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propan-1-amine
  • CAS Number: 5626-16-4
  • Molecular Formula: C17H17NO
  • Molecular Weight: 251.32300
  • Create Date: 2016-12-08 05:13:19
  • Modify Date: 2025-08-25 16:41:20

Name (3Z)-3-(6H-benzo[c][1]benzoxepin-11-ylidene)propan-1-amine
Synonyms Didemethyldoxepin
KS 1675
Density 1.184g/cm3
Boiling Point 418.6ºC at 760 mmHg
Molecular Formula C17H17NO
Molecular Weight 251.32300
Flash Point 213.8ºC
Exact Mass 251.13100
PSA 35.25000
LogP 4.05980
Index of Refraction 1.667

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HQ4260000
CHEMICAL NAME :
Dibenz(b,e)oxepin-delta(sup 11(6H)),gamma-propylamine
CAS REGISTRY NUMBER :
5626-16-4
LAST UPDATED :
199712
DATA ITEMS CITED :
5
MOLECULAR FORMULA :
C17-H17-N-O
MOLECULAR WEIGHT :
251.35
WISWESSER LINE NOTATION :
T C676 BY IO JHJ BU3Z

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 15,863,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
118 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 15,863,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
92 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 15,863,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
29 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 15,863,1965
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - rabbit
DOSE/DURATION :
13400 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 15,863,1965
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