3-(p-Chlorobenzoyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane

Modify Date: 2025-09-01 11:55:46

3-(p-Chlorobenzoyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane Structure
3-(p-Chlorobenzoyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane structure
 Common Name 3-(p-Chlorobenzoyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane
CAS Number 57269-18-8 Molecular Weight 264.75100
Density 1.236g/cm3 Boiling Point 401.7ºC at 760 mmHg
Molecular Formula C14H17ClN2O Melting Point N/A
MSDS N/A Flash Point 196.7ºC

 Names

Name (4-chlorophenyl)-(8-methyl-3,8-diazabicyclo[3.2.1]octan-3-yl)methanone

 Chemical & Physical Properties

Density 1.236g/cm3
Boiling Point 401.7ºC at 760 mmHg
Molecular Formula C14H17ClN2O
Molecular Weight 264.75100
Flash Point 196.7ºC
Exact Mass 264.10300
PSA 23.55000
LogP 2.13440
Index of Refraction 1.588
InChIKey IKHUSJCGKQISRF-UHFFFAOYSA-N
SMILES CN1C2CCC1CN(C(=O)c1ccc(Cl)cc1)C2

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
HM0376500
CHEMICAL NAME :
3,8-Diazabicyclo(3.2.1)octane, 3-(p-chlorobenzoyl)-8-methyl-
CAS REGISTRY NUMBER :
57269-18-8
BEILSTEIN REFERENCE NO. :
0540818
LAST UPDATED :
199712
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H17-Cl-N2-O
MOLECULAR WEIGHT :
264.78
WISWESSER LINE NOTATION :
T56 A AN GNTJ A1 GVR DG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
80 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
RPOBAR Research Progress in Organic-Biological and Medicinal Chemistry. (New York, NY) V.1-3, 1964-72. Discontinued. Volume(issue)/page/year: 2,206,1970
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Chemsrc provides CAS#:57269-18-8 MSDS, density, melting point, boiling point, structure, etc. Its name is 3-(p-Chlorobenzoyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane>> amp version: 3-(p-Chlorobenzoyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane

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