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5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-ol

Catalog No: FT-0688004

CAS No: 35978-37-1

Chemical Name: 5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-ol
Molecular Formula: C12H7FN2OS
Molecular Weight: 246.26
InChI Key: DARIIFLATJJEOB-UHFFFAOYSA-N
InChI: InChI=1S/C12H7FN2OS/c13-8-3-1-7(2-4-8)9-5-17-12-10(9)11(16)14-6-15-12/h1-6H,(H,14,15,16)

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:	5-(4-Fluorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one
Flash_Point:	N/A
Melting_Point:	N/A
FW:	246.26000
Density:	N/A
CAS:	35978-37-1
Bolling_Point:	N/A
MF:	C12H7FN2OS

Computational_Chemistry:	['1. XlogP :24 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :4 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :4 ', '6. TPSA 697 ', '7. Heavy Atom Count :17 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :341 ', '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']
Molecular_Structure:	['1 . Molar refractive index 6484 ', '2 . Molar volume 1643 ', '3 . Parachor （902K）4481 ', '4 . Surface tension 552 ', '5 . Polarizability 2570']
LogP:	2.79070
FW:	246.26000
PSA:	73.99000
MF:	C12H7FN2OS
More_Info:	['1. Melting point（760 mmHg,ºC）240-242']
Exact_Mass:	246.02600