1-[2-(diethylamino)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one

Catalog No: FT-0759391

CAS No: 3105-97-3

Chemical Name: 1-[2-(diethylamino)ethylamino]-4-(hydroxymethyl)thioxanthen-9-one
Molecular Formula: C20H24N2O2S
Molecular Weight: 356.5
InChI Key: MFZWMTSUNYWVBU-UHFFFAOYSA-N
InChI: InChI=1S/C20H24N2O2S/c1-3-22(4-2)12-11-21-16-10-9-14(13-23)20-18(16)19(24)15-7-5-6-8-17(15)25-20/h5-10,21,23H,3-4,11-13H2,1-2H3

Product pricing and availability information
Assay	Pack Size	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Melting_Point:	approx 143ºC
FW:	356.48200
CAS:	3105-97-3
MF:	C20H24N2O2S
Flash_Point:	298.9ºC
Product_Name:	Hycanthone
Bolling_Point:	570.5ºC at 760mmHg
Density:	1.25g/cm3

FW:	356.48200
Melting_Point:	approx 143ºC
Refractive_Index:	1.658
MF:	C20H24N2O2S
Exact_Mass:	356.15600
LogP:	3.73370
Bolling_Point:	570.5ºC at 760mmHg
Density:	1.25g/cm3
PSA:	80.81000
Computational_Chemistry:	['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :7 ', '5. Isotope Atom Count :5 ', '6. TPSA :779 ', '7. Heavy Atom Count :25 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :443 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Flash_Point:	298.9ºC