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8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide

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Name

8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide

EINECS N/A
CAS No. 54484-91-2 Density 1.39g/cm3
PSA 82.10000 LogP 4.92520
Solubility N/A Melting Point N/A
Formula C20H22ClN3O2S Boiling Point 627.7°C at 760 mmHg
Molecular Weight 403.96 Flash Point 333.4°C
Transport Information N/A Appearance N/A
Safety Moderately toxic by intramuscular route. Mutation data reported. When heated to decomposition it emits very toxic fumes of SOx, NOx, and Cl. Risk Codes N/A
Molecular Structure Molecular Structure of 54484-91-2 (8-Chloro-5-(hydroxymethyl)-N,N-diethyl-2H-[1]benzothiopyrano[4,3,2-cd]indazole-2-ethan-1-amineN-oxide) Hazard Symbols N/A
Synonyms

IA-4 N-Oxide;8-Chloro-5-hydroxymethylbenzothiopyranoindazole N-oxide;

 

8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide Chemical Properties

Molecular Structure of 8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide (CAS NO.54484-91-2):

Empirical Formula:  C20H22ClN3O2
Molecular Weight:  403.9256 
Surface Tension:  53.9 dyne/cm 
Density:  1.39 g/cm
Flash Point:  333.4 °C 
Enthalpy of Vaporization:  97.64 kJ/mol 
Boiling Point:  627.7 °C at 760 mmHg 
Vapour Pressure:  1.27E-16 mmHg at 25°C 
Index of Refraction:  1.686 
Classification Code:  Mutation data;Drug / Therapeutic Agent

8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide Toxicity Data With Reference

1.    

mmo-sat 492 nmol/plate

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 200 (1977),1.
2.    

mma-sat 492 nmol/plate

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 200 (1977),1.
3.    

sln-dmg-par 2800 µmol/L

    MUREAV    Mutation Research. 82 (1981),111.
4.    

bfa-mus/sat 200 mg/kg

    CNREA8    Cancer Research. 38 (1978),4478.
5.    

hma-mus/sat 100 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 200 (1977),1.
6.    

ims-mus LD50:3500 mg/kg

    JPETAB    Journal of Pharmacology and Experimental Therapeutics. 200 (1977),1.

8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide Consensus Reports

EPA Genetic Toxicology Program.

8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide Safety Profile

Moderately toxic by intramuscular route. Mutation data reported. When heated to decomposition it emits very toxic fumes of SOx, NOx, and Cl.

8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide Specification

 8-Chloro-2-(2-(diethylamino)ethyl)-2h-(1)benzothiopyrano(4,3,2-cd)indaz-ole-5-methanol-n-oxide , with CAS number of 54484-91-2, can be called IA-4 N-Oxide ; BRN 1092010 .

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