2-pyridin-2-yl-4-(trifluoromethyl)pyrimidine-5-carboxylic acid

Catalog No: FT-0687936

CAS No: 874816-10-1

Chemical Name: 2-pyridin-2-yl-4-(trifluoromethyl)pyrimidine-5-carboxylic acid
Molecular Formula: C11H6F3N3O2
Molecular Weight: 269.18
InChI Key: YUBDBOSNEOIDLU-UHFFFAOYSA-N
InChI: InChI=1S/C11H6F3N3O2/c12-11(13,14)8-6(10(18)19)5-16-9(17-8)7-3-1-2-4-15-7/h1-5H,(H,18,19)

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:	2-pyridin-2-yl-4-(trifluoromethyl)pyrimidine-5-carboxylic acid
Flash_Point:	N/A
Melting_Point:	N/A
FW:	269.17900
Density:	N/A
CAS:	874816-10-1
Bolling_Point:	N/A
MF:	C11H6F3N3O2

Computational_Chemistry:	['1. XlogP :13 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :8 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 76 ', '7. Heavy Atom Count :19 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :338 ', '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 5702 ', '2 . Molar volume 1804 ', '3 . Parachor （902K）4824 ', '4 . Surface tension 511 ', '5 . Polarizability 2260']
LogP:	2.25560
FW:	269.17900
PSA:	75.97000
MF:	C11H6F3N3O2
Exact_Mass:	269.04100