| CAS Number | 933988-20-6 |
| Catalog Number | AG006FYF(AGN-PC-0WB3TV) |
| Chemical Name | 2-pyridin-3-ylpyrimidine-5-carboxylic acid |
| IUPAC Name | 2-pyridin-3-ylpyrimidine-5-carboxylic acid |
| InChI | InChI=1S/C10H7N3O2/c14-10(15)8-5-12-9(13-6-8)7-2-1-3-11-4-7/h1-6H,(H,14,15) |
| InChI Key | MORKTPRONBOIJR-UHFFFAOYSA-N |
| MDL Number | MFCD09863214 |
| Molecular Formula | C10H7N3O2 |
| Molecular Weight | 201.1815 |
| SMILES | C1(C2=CC=CN=C2)=NC=C(C=N1)C(O)=O |
| Synonyms | 933988-20-6,
2-pyridin-3-ylpyrimidine-5-carboxylic acid,
2-(PYRIDIN-3-YL)PYRIMIDINE-5-CARBOXYLIC ACID,
2-(3-pyridinyl)-5-pyrimidinecarboxylic acid,
SCHEMBL3232965,
CTK5H2448,
DTXSID70647961,
MORKTPRONBOIJR-UHFFFAOYSA-N,
MFCD09863214,
ZINC19091377,
AKOS000284188,
AJ-71594,
AS-41517,
2-pyridin-3-yl-pyrimidine-5-carboxylic acid,
FT-0712115,
5-Pyrimidinecarboxylic acid, 2-(3-pyridinyl)-,
Y-5631,
2-pyridin-3-ylpyrimidine-5-carboxylicacid,
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| Complexity | 227 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 201.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 201.185g/mol |
| Monoisotopic Mass | 201.054g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 76A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number