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4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;dihydrate;dihydrochloride

Catalog No: FT-0740309

CAS No: 6398-98-7

Chemical Name: 4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;dihydrate;dihydrochloride
Molecular Formula: C20H28Cl3N3O3
Molecular Weight: 464.8
InChI Key: YVNAYSHNIILOJS-UHFFFAOYSA-N
InChI: InChI=1S/C20H22ClN3O.2ClH.2H2O/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19;;;;/h5-12,25H,3-4,13H2,1-2H3,(H,22,23);2*1H;2*1H2

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:	N/A
FW:	464.814
CAS:	6398-98-7
MF:	C20H24Cl3N3O
Flash_Point:	277.6ºC
Product_Name:	Amodiaquin dihydrochloride dihydrate
Bolling_Point:	535.4ºC at 760 mmHg
Density:	N/A

FW:	464.814
Flash_Point:	277.6ºC
LogP:	6.85620
Bolling_Point:	535.4ºC at 760 mmHg
More_Info:	['1 . Appearance Yellow 结晶性粉末，无嗅or 近乎无嗅 ', '2 . Density（g/mL, 25 ℃ ）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，1mmHg）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（20ºC）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']
Computational_Chemistry:	['1 . Hydrogen Bond Donor Count 6 ', '2 . Hydrogen Bond Acceptor Count 6 ', '3 . Rotatable Bond Count 6 ', '4 . Isotope Atom Count 13 ', '5 . TPSA 504 ', '6 . Heavy Atom Count 29 ', '7 . Topological Polar Surface Area 0 ', '8 . Complexity 406 ', '9 . Isotope Atom Count 0 ', '10 . Defined Atom Stereocenter Count 0 ', '11 . Undefined Atom Stereocenter Count 0 ', '12 . Defined Bond Stereocenter Count 0 ', '13 . Undefined Bond Stereocenter Count 0 ', '14 . Covalently-Bonded Unit Count 5']
MF:	C20H24Cl3N3O
Exact_Mass:	463.119629
Molecular_Structure:	['1 . Molar refractive index 10550 ', '2 . Molar volume （m3/mol）2827 ', '3 . Parachor （902K）7711 ', '4 . Surface tension 552 ', '5 . Polarizability （10 -24cm 3）4182']
PSA:	48.39000