FT-0603611 CAS:2519-30-4 chemical structure

Food Black 1

Name: Food Black 1
Rating: 4.5 (11 reviews)

Catalog No: FT-0603611

CAS No: 2519-30-4

Molecular Formula: 867.7
Formula Weight: C28H17N5Na4O14S4
Inchl Key: GMMAPXRGRVJYJY-UHFFFAOYSA-J
Inchl: InChI=1S/C28H21N5O14S4.4Na/c1-14(34)29-23-10-11-24(50(42,43)44)20-13-25(51(45,46)47)27(28(35)26(20)23)33-32-22-9-8-21(18-7-6-17(12-19(18)22)49(39,40)41)31-30-15-2-4-16(5-3-15)48(36,37)38;;;;/h2-13,35H,1H3,(H,29,34)(H,36,37,38)(H,39,40,41)(H,42,43,44)(H,45,46,47);;;;/q;4*+1/p-4

Assay	Pack	Price	Stock
98%	1g	N/A	N/A
98%	5g	N/A	N/A
98%	Bulk Quantity	N/A	N/A

Product_Name:	Brilliant Black BN
Flash_Point:	N/A
Melting_Point:	N/A
FW:	867.679
Density:	N/A
CAS:	2519-30-4
Bolling_Point:	N/A
MF:	C28H17N5Na4O14S4

Computational_Chemistry:	['1 . XlogP ', '2 . Hydrogen Bond Donor Count 2 ', '3 . Hydrogen Bond Acceptor Count 18 ', '4 . Rotatable Bond Count 5 ', '5 . Isotope Atom Count 21 ', '6 . TPSA 324 ', '7 . Heavy Atom Count 55 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 1850 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 0 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 1 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 5']
LogP:	8.50040
FW:	867.679
PSA:	361.09000
MF:	C28H17N5Na4O14S4
More_Info:	['1 . Appearance 黑色粉末or 颗粒 ', '2 . Density（g/mL, ,20℃）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 746mmHg）Unknow ', '7 . Refractive index（n20/D）Unknow ', '8 . Flash point（ºC）Unknow ', '9 . Specific rotation（）Unknow ', '10 . Spontaneous ignition point or ignition temperature（ºC）Unknow ', '11 . Vapor pressure（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（kPa, 0ºC）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 Soluble in Water 。微Soluble in Ethanol ']
Exact_Mass:	866.924561