1(2H)-Phthalazinone, 2-(1-(2-(4-chlorophenyl)ethyl)hexahydro-1H-azepin-4-yl)-4-((4-chlorophenyl)methyl)-, monohydrochloride

Modify Date: 2024-04-08 19:45:12

1(2H)-Phthalazinone, 2-(1-(2-(4-chlorophenyl)ethyl)hexahydro-1H-azepin-4-yl)-4-((4-chlorophenyl)methyl)-, monohydrochloride Structure
1(2H)-Phthalazinone, 2-(1-(2-(4-chlorophenyl)ethyl)hexahydro-1H-azepin-4-yl)-4-((4-chlorophenyl)methyl)-, monohydrochloride structure
 Common Name 1(2H)-Phthalazinone, 2-(1-(2-(4-chlorophenyl)ethyl)hexahydro-1H-azepin-4-yl)-4-((4-chlorophenyl)methyl)-, monohydrochloride
CAS Number 110406-41-2 Molecular Weight 542.92700
Density N/A Boiling Point 642.6ºC at 760mmHg
Molecular Formula C29H30Cl3N3O Melting Point N/A
MSDS N/A Flash Point 342.4ºC

 Names

Name 2-[1-[2-(4-chlorophenyl)ethyl]azepan-4-yl]-4-[(4-chlorophenyl)methyl]phthalazin-1-one,hydrochloride

 Chemical & Physical Properties

Boiling Point 642.6ºC at 760mmHg
Molecular Formula C29H30Cl3N3O
Molecular Weight 542.92700
Flash Point 342.4ºC
Exact Mass 541.14500
PSA 38.13000
LogP 7.30370
Vapour Pressure 2.1E-16mmHg at 25°C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TH9203710
CHEMICAL NAME :
1(2H)-Phthalazinone, 2-(1-(2-(4-chlorophenyl)ethyl)hexahydro-1H-azepin-4-y l)-4- ((4-chlorophenyl)methyl)-, monohydrochloride
CAS REGISTRY NUMBER :
110406-41-2
LAST UPDATED :
199609
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C29-H29-Cl2-N3-O.Cl-H
MOLECULAR WEIGHT :
542.97

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4841047
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