H-RESORCINOL

Catalog No: FT-0634936

CAS No: 3627-01-8

Chemical Name: H-RESORCINOL
Molecular Formula: C16H12N2O9S2
Molecular Weight: 440.4
InChI Key: BTEWRTUJKSQHIE-UHFFFAOYSA-N
InChI: InChI=1S/C16H12N2O9S2/c19-9-1-2-12(14(20)5-9)17-18-13-6-10(28(22,23)24)3-8-4-11(29(25,26)27)7-15(21)16(8)13/h1-7,19-21H,(H,22,23,24)(H,25,26,27)

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

Product_Name:	H-Resorcinol [Spectrophotometric reagent for the determination of B by FIA]
Flash_Point:	N/A
Melting_Point:	N/A
FW:	440.40400
Density:	1.828g/cm3
CAS:	3627-01-8
Bolling_Point:	N/A
MF:	C16H12N2O9S2

Molecular_Structure:	['1 . Molar refractive index 9851 ', '2 . Molar volume （m3/mol）2409 ', '3 . Parachor （902K）7378 ', '4 . Surface tension 880 ', '5 . Polarizability （10 -24cm 3）3905']
LogP:	5.02700
Refractive_Index:	1.754
FW:	440.40400
Density:	1.828g/cm3
Computational_Chemistry:	['1 疏水参数计算参考值（XlogP3-AA）1 ', '2 . Hydrogen Bond Donor Count 5 ', '3 . Hydrogen Bond Acceptor Count 11 ', '4 . Rotatable Bond Count 4 ', '5 . Isotope Atom Count 84 ', '6 . TPSA 191 ', '7 . Heavy Atom Count 29 ', '8 . Topological Polar Surface Area 0 ', '9 . Complexity 973 ', '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 1']
PSA:	210.91000
Exact_Mass:	439.99800
More_Info:	['1 . Appearance 不确定 ', '2 . Densityd（g/mL,25/4℃）不确定 ', '3 . Relative vapor density（g/mL,Atmosphere =1）不确定 ', '4 . Melting pointmp（ºC）不确定 ', '5 . Boiling point（ºC,Atmospheric pressure）不确定 ', '6 . Boiling pointbp（ºC, 24mm ）不确定 ', '7 . Refractive index不确定 ', '8 . Flash pointfp（ºC）不确定 ', '9 . Specific rotation（º）不确定 ', '10 . Spontaneous ignition point or ignition temperature（ºC）不确定 ', '11 . Vapor pressure（kPa,25ºC）不确定 ', '12 . Saturated vapor pressure（kPa,60ºC）不确定 ', '13 . Combustion heat（KJ/mol）不确定 ', '14 . Critical temperature（ºC）不确定 ', '15 . Critical pressure（KPa）不确定 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 不确定 ', '17 . Upper limit of explosion（%,V/V）不确定 ', '18 . Lower limit of explosion（%,V/V）不确定 ', '19 . Solubility 不确定']
MF:	C16H12N2O9S2