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101652-02-2

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Basic Information
CAS No.: 101652-02-2
Name: 2-(7,8-dichloro-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-N,N-dimethylethanaminium hydrogen sulfate
Molecular Structure:
Molecular Structure of 101652-02-2 (2-(7,8-dichloro-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-N,N-dimethylethanaminium hydrogen sulfate)
Formula: C14H13Cl2N5O2•H2O4S
Molecular Weight: 452.30
Density: g/cm3
Boiling Point: °Cat760mmHg
Flash Point: °C
Safety: Poison by subcutaneous and intravenous routes. See also SULFATES and CHLORIDES. When heated to decomposition it emits very toxic fumes of SOx, NOx, and Cl−.
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  • 2-(7,8-dichloro-2,4-dioxobenzo[g]pteridin-10-yl)ethyl-dimethylazanium;hydrogen sulfate

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    2-(7,8-dichloro-2,4-dioxobenzo[g]pteridin-10-yl)ethyl-dimethylazanium;hydrogen sulfate

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  • 7,8-DICHLORO-10-(2-(DIMETHYLAMINO)-ETHYL)ISOALLOXAZINE SULFATE

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    101652-02-2

    7,8-DICHLORO-10-(2-(DIMETHYLAMINO)-ETHYL)ISOALLOXAZINE SULFATE

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    factory?direct?sale Application:Fine chemical intermediates, used as the main raw material for the synthesis of various pesticides, medicines, surfactants, polymer monomers, and antifungal agents

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Chemistry

IUPAC Name: 2-(7,8-Dichloro-2,4-dioxobenzo[g]pteridin-10-yl)ethyl-dimethylazanium; hydrogen sulfate
Synonyms of 7,8-Dichloro-10-(2-(dimethylamino)ethyl)isoalloxazine sulfate (CAS NO.101652-02-2): Isoalloxazine, 7,8-dichloro-10-(2-(dimethylamino)ethyl)-, sulfate
CAS NO: 101652-02-2
Molecular Formula: C14H15Cl2N5O6S
Molecular Weight: 452.2698
Molecular Structure :
H bond acceptors: 7
H bond donors: 1
Freely Rotating Bonds: 3
Polar Surface Area: 65.34 Å2
InChI: InChI=1/C14H13Cl2N5O2.H2O4S/c1-20(2)3-4-21-10-6-8(16)7(15)5-9(10)17-11-12(21)18-14(23)19-13(11)22;1-5(2,3)4/h5-6H,3-4H2,1-2H3,(H,19,22,23);(H2,1,2,3,4)
InChIKey: ILWSCPUNIIYEBG-UHFFFAOYAL
Std. InChI: InChI=1S/C14H13Cl2N5O2.H2O4S/c1-20(2)3-4-21-10-6-8(16)7(15)5-9(10)17-11-12(21)18-14(23)19-13(11)22;1-5(2,3)4/h5-6H,3-4H2,1-2H3,(H,19,22,23);(H2,1,2,3,4)
Std. InChIKey: ILWSCPUNIIYEBG-UHFFFAOYSA-N

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 18mg/kg (18mg/kg)   Chemotherapia. Vol. 2, Pg. 96, 1961.
mouse LD50 subcutaneous 30mg/kg (30mg/kg)   Chemotherapia. Vol. 2, Pg. 96, 1961.

Safety Profile

Poison by subcutaneous and intravenous routes. See also SULFATES and CHLORIDES. When 7,8-Dichloro-10-(2-(dimethylamino)ethyl)isoalloxazine sulfate (CAS NO.101652-02-2) is heated to decomposition, it emits very toxic fumes of SOx, NOx, and Cl−.