[6-(diethylamino)-9-[2-[[9-(diethylamino)-6,12-dihydrobenzo[a]phenoxazin-5-ylidene]carbamoyl]phenyl]xanthen-3-ylidene]-diethylazanium;chloride

Catalog No: FT-0762666

CAS No: 14969-56-3

Chemical Name: [6-(diethylamino)-9-[2-[[9-(diethylamino)-6,12-dihydrobenzo[a]phenoxazin-5-ylidene]carbamoyl]phenyl]xanthen-3-ylidene]-diethylazanium;chloride
Molecular Formula: C48H48ClN5O3
Molecular Weight: 778.4
InChI Key: UYQVPCFMVWEDCA-UHFFFAOYSA-M
InChI: InChI=1S/C48H48N5O3.ClH/c1-7-51(8-2)31-21-24-38-42(27-31)55-43-28-32(52(9-3)10-4)22-25-39(43)46(38)35-18-14-16-20-37(35)48(54)50-41-30-45-47(36-19-15-13-17-34(36)41)49-40-26-23-33(29-44(40)56-45)53(11-5)12-6;/h13-30H,7-12H2,1-6H3;1H/q+1;/p-1

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

Bolling_Point:	N/A
CAS:	14969-56-3
MF:	C48H50ClN5O3
Density:	N/A
Melting_Point:	N/A
Product_Name:	rhodanile blue
Flash_Point:	N/A
FW:	780.39500

PSA:	73.32000
MF:	C48H50ClN5O3
LogP:	7.05730
Computational_Chemistry:	['1. XlogP ', '2. Hydrogen Bond Donor Count 0 ', '3. Hydrogen Bond Acceptor Count 7 ', '4. Rotatable Bond Count ；10 ', '5. Isotope Atom Count ', '6. TPSA ；697 ', '7. Heavy Atom Count 57 ', '8. Topological Polar Surface Area 0 ', '9. Complexity 1640 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 <P class=p0 style="MARGIN-TOP: 5pt; MARGIN-BOTTOM: 5pt; MARGIN-LEFT: 36pt; TEXT-IND']
More_Info:	['1. Appearance Unknow ', '2. Density（g/mL,25/4℃）Unknow ', '3. Relative vapor density（g/mL,Atmosphere =1）Unknow ', '4. Melting point（ºC）Unknow ', '5. Boiling point（ºC,Atmospheric pressure）Unknow ', '6. Boiling point（ºC,52kPa）Unknow ', '7. Refractive indexUnknow ', '8. Flash point（ºC）Unknow ', '9. Specific rotation（º）Unknow ', '10. Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11. Vapor pressure（kPa,25ºC）Unknow ', '12. Saturated vapor pressure（kPa,60ºC）Unknow ', '13. Combustion heat（KJ/mol）Unknow ', '14. Critical temperature（ºC）Unknow ', '15. Critical pressure（KPa）Unknow ', '16. Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient Unknow ', '17. Upper limit of explosion（%,V/V）Unknow ', '18. Lower limit of explosion（%,V/V）Unknow ', '19. Solubility Unknow']
Exact_Mass:	779.36000
Vapor_Pressure:	1.58E-31mmHg at 25°C
FW:	780.39500
Refractive_Index:	1.639