Chemical Name: Repirinast
Molecular Formula: C20H21NO5
Molecular Weight: 355.4
InChI Key: NFQIAEMCQGTTIR-UHFFFAOYSA-N
InChI: InChI=1S/C20H21NO5/c1-10(2)7-8-25-20(24)15-9-14(22)16-18(26-15)13-6-5-11(3)12(4)17(13)21-19(16)23/h5-6,9-10H,7-8H2,1-4H3,(H,21,23)

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

Refractive_Index:	1.731
Vapor_Pressure:	0.0±1.1 mmHg at 25°C
Flash_Point:	232.6±31.5 °C
LogP:	0.46
Bolling_Point:	461.1±55.0 °C at 760 mmHg
FW:	221.219
PSA:	89.37000
Computational_Chemistry:	['1. XlogP :34 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :5 ', '4. Rotatable Bond Count :5 ', '5. Isotope Atom Count :22 ', '6. TPSA 817 ', '7. Heavy Atom Count :26 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :690 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
MF:	C8H11N7O
Exact_Mass:	221.102509
Molecular_Structure:	['1 . Molar refractive index 9504 ', '2 . Molar volume 2863 ', '3 . Parachor （902K）7584 ', '4 . Surface tension 491 ', '5 . Polarizability 3768']
Density:	1.6±0.1 g/cm3
More_Info:	['1. Appearance 从氯仿-己烷结晶。 ', '2. Melting point（℃）236-241。']