| CAS Number | 1182748-63-5 |
| Catalog Number | AG019XHL(AGN-PC-0WOC7E) |
| Chemical Name | 2-(4-Fluorobenzoyl)pyrimidine |
| IUPAC Name | (4-fluorophenyl)-pyrimidin-2-ylmethanone |
| InChI | InChI=1S/C11H7FN2O/c12-9-4-2-8(3-5-9)10(15)11-13-6-1-7-14-11/h1-7H |
| InChI Key | VWPIUVPYXFOGMA-UHFFFAOYSA-N |
| MDL Number | MFCD12153439 |
| Molecular Formula | C11H7FN2O |
| Molecular Weight | 202.1845 |
| SMILES | FC1=CC=C(C(C2=NC=CC=N2)=O)C=C1 |
| Synonyms | 2-(4-fluorobenzoyl)pyrimidine,
2-[(4-fluorophenyl)carbonyl]pyrimidine,
1182748-63-5,
AC1Q4LW2,
CTK7G0547,
ZINC37464341,
AKOS008141419,
MCULE-4945240881,
NE20839,
EN300-55022,
Z839028624,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.054g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.188g/mol |
| Monoisotopic Mass | 202.054g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number