| CAS Number | 1094411-86-5 |
| Catalog Number | AG019VXD(AGN-PC-0WO67P) |
| Chemical Name | 2-(3-Fluorophenyl)pyrimidin-5-amine |
| IUPAC Name | 2-(3-fluorophenyl)pyrimidin-5-amine |
| InChI | InChI=1S/C10H8FN3/c11-8-3-1-2-7(4-8)10-13-5-9(12)6-14-10/h1-6H,12H2 |
| InChI Key | AIHATZXQZIYIPB-UHFFFAOYSA-N |
| MDL Number | MFCD11180887 |
| Molecular Formula | C10H8FN3 |
| Molecular Weight | 189.1890 |
| SMILES | Nc1cnc(nc1)c1cccc(c1)F |
| Synonyms | 2-(3-fluorophenyl)pyrimidin-5-amine,
1094411-86-5,
AC1Q52HI,
CTK7E0360,
ZINC36379561,
AKOS009310073,
MCULE-4591650133,
NE61066,
EN300-49778,
AB01007132-01,
Z489283804,
|
| Complexity | 180 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 189.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.193g/mol |
| Monoisotopic Mass | 189.07g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number