| CAS Number | 956135-56-1 |
| Catalog Number | AG01B3ZP |
| Chemical Name | 5-bromo-N-(3-fluorophenyl)pyrimidin-2-amine |
| IUPAC Name | 5-bromo-N-(3-fluorophenyl)pyrimidin-2-amine |
| InChI | InChI=1S/C10H7BrFN3/c11-7-5-13-10(14-6-7)15-9-3-1-2-8(12)4-9/h1-6H,(H,13,14,15) |
| InChI Key | FNGLVZNFUIKRKQ-UHFFFAOYSA-N |
| MDL Number | MFCD18631309 |
| Molecular Formula | C10H7BrFN3 |
| Molecular Weight | 268.0851 |
| SMILES | FC1=CC(NC2=NC=C(Br)C=N2)=CC=C1 |
| Synonyms | 5-bromo-N-(3-fluorophenyl)pyrimidin-2-amine,
956135-56-1,
SCHEMBL180866,
FNGLVZNFUIKRKQ-UHFFFAOYSA-N,
ZINC71599523,
AKOS013188318,
(5-Bromopyrimidin-2-yl)-(3-fluorophenyl)-amine,
A1-08757,
Z2509351254,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.981g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.089g/mol |
| Monoisotopic Mass | 266.981g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number