Chemical Name: BIS(2,4-DINITROPHENYL)-L-HISTIDINE
Molecular Formula: C18H13N7O10
Molecular Weight: 487.3
InChI Key: WOZYZMUUGRWSLF-UHFFFAOYSA-N
InChI: InChI=1S/C18H13N7O10/c26-18(27)14(20-13-3-1-11(22(28)29)6-16(13)24(32)33)5-10-8-21(9-19-10)15-4-2-12(23(30)31)7-17(15)25(34)35/h1-4,6-9,14,20H,5H2,(H,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

Base Information
Chemical Information

Product_Name:	N,N′-Di(DNP)-L-histidine
Flash_Point:	446.2ºC
Melting_Point:	N/A
FW:	487.33700
Density:	1.78g/cm3
CAS:	3129-33-7
Bolling_Point:	814.1ºC at 760mmHg
MF:	C18H13N7O10

Molecular_Structure:	['1 . Molar refractive index 11443 ', '2 . Molar volume （m3/mol）2818 ', '3 . Parachor （902K）8860 ', '4 . Surface tension 977 ', '5 . Polarizability 4536']
LogP:	4.77870
Flash_Point:	446.2ºC
Refractive_Index:	1.76
FW:	487.33700
Density:	1.78g/cm3
Bolling_Point:	814.1ºC at 760mmHg
Computational_Chemistry:	['1. XlogP :31 ', '2. Hydrogen Bond Donor Count :2 ', '3. Hydrogen Bond Acceptor Count :12 ', '4. Rotatable Bond Count :6 ', '5. Isotope Atom Count :N/A ', '6. TPSA 250 ', '7. Heavy Atom Count :35 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :838 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
PSA:	250.43000
MF:	C18H13N7O10
More_Info:	['1 . Appearance 无可用 ', '2 . Density（g/mL,25/4℃）无可用 ', '3 . Relative vapor density（g/mL,Atmosphere =1）无可用 ', '4 . Melting point（ºC）无可用 ', '5 . Boiling point（ºC,Atmospheric pressure）无可用 ', '6 . Boiling point（ºC,52kPa）无可用 ', '7 . Refractive index无可用 ', '8 . Flash point（ºC）无可用 ', '9 . Specific rotation（º）无可用 ', '10 . Spontaneous ignition point or ignition temperature（ºC）无可用 ', '11 . Vapor pressure（kPa,25ºC）无可用 ', '12 . Saturated vapor pressure（kPa,60ºC）无可用 ', '13 . Combustion heat（KJ/mol）无可用 ', '14 . Critical temperature（ºC）无可用 ', '15 . Critical pressure（KPa）无可用 ', '16 . Oil-water（Octanol /Water ）Logarithmic Value of Distribution Coefficient 无可用 ', '17 . Upper limit of explosion（%,V/V）无可用 ', '18 . Lower limit of explosion（%,V/V）无可用 ', '19 . Solubility 无可用']
Exact_Mass:	487.07200