| CAS Number | 933759-51-4 |
| Catalog Number | AG01BV2M |
| Chemical Name | 6-(Morpholin-4-yl)pyrimidine-4-carboxylic acid |
| IUPAC Name | 6-morpholin-4-ylpyrimidine-4-carboxylic acid |
| InChI | InChI=1S/C9H11N3O3/c13-9(14)7-5-8(11-6-10-7)12-1-3-15-4-2-12/h5-6H,1-4H2,(H,13,14) |
| InChI Key | FIOMMYGNTCJCQK-UHFFFAOYSA-N |
| MDL Number | MFCD21884060 |
| Molecular Formula | C9H11N3O3 |
| Molecular Weight | 209.2019 |
| SMILES | OC(C1=NC=NC(N2CCOCC2)=C1)=O |
| Synonyms | CHEMBL3407870,
6-(morpholin-4-yl)pyrimidine-4-carboxylic acid,
933759-51-4,
SCHEMBL2163130,
BDBM50072088,
ZINC71511390,
AKOS022539983,
6-morpholinopyrimidine-4-carboxylic acid,
F1967-2192,
Z2678251529,
|
| Complexity | 231 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 209.08g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.205g/mol |
| Monoisotopic Mass | 209.08g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number