CGS-21680 HYDROCHLORIDE

Catalog No: FT-0651298

CAS No: 124182-57-6

Chemical Name: CGS-21680 HYDROCHLORIDE
Molecular Formula: C23H30ClN7O6
Molecular Weight: 536.0 g/mol
InChI Key: QPHVMNOEKKJYJO-MJWSIIAUSA-N
InChI: InChI=1S/C23H29N7O6.ClH/c1-2-25-21(35)18-16(33)17(34)22(36-18)30-11-27-15-19(24)28-23(29-20(15)30)26-10-9-13-5-3-12(4-6-13)7-8-14(31)32;/h3-6,11,16-18,22,33-34H,2,7-10H2,1H3,(H,25,35)(H,31,32)(H3,24,26,28,29);1H/t16-,17+,18-,22+;/m0./s1

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

FW:	535.981
CAS:	124182-57-6
Melting_Point:	N/A
Bolling_Point:	934.4ºC at 760 mmHg
MF:	C23H30ClN7O6
Product_Name:	CGS-21680 hydrochloride hydrate
Flash_Point:	518.9ºC
Density:	N/A

FW:	535.981
MF:	C23H30ClN7O6
LogP:	1.68270
More_Info:	['1 . Appearance White Solid ', '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,KPa）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（Pa,20ºC）Unknow ', '12 . Saturated vapor pressure（KPa,20ºC）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 蒽醌2 -羟丙基- β -环糊精20mg/ml']
Bolling_Point:	934.4ºC at 760 mmHg
Exact_Mass:	535.194580
PSA:	197.74000
Computational_Chemistry:	['1 . XlogP ', '2 . Hydrogen Bond Donor Count 7 ', '3 . Hydrogen Bond Acceptor Count 11 ', '4 . Rotatable Bond Count 10 ', '5 . Isotope Atom Count 18 ', '6 . TPSA 198 ', '7 . Heavy Atom Count 37 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 755 ', '10. Isotope Atom Count 0 ', '11. Defined Atom Stereocenter Count 4 ', '12. Undefined Atom Stereocenter Count 0 ', '13. Defined Bond Stereocenter Count 0 ', '14. Undefined Bond Stereocenter Count 0 ', '15. Covalently-Bonded Unit Count 2']
Vapor_Pressure:	0mmHg at 25°C
Flash_Point:	518.9ºC
Molecular_Structure:	['1. Molar refractive index N/A ', '2. Molar volume N/A ', '3. Parachor （902K）N/A ', '4. Surface tension N/A ', '5. Dielectric constant N/A ', '6. Polarizability N/A ', '7. Single isotope mass 535194609 Da ', '8. Nominal mass 535 Da ', '9. Average mass 5359806 Da']