| CAS Number | 1250891-98-5 |
| Catalog Number | AG01BG2S(AGN-PC-0WOQQS) |
| Chemical Name | 6-(5-Bromofuran-2-yl)pyrimidin-4-amine |
| IUPAC Name | 6-(5-bromofuran-2-yl)pyrimidin-4-amine |
| InChI | InChI=1S/C8H6BrN3O/c9-7-2-1-6(13-7)5-3-8(10)12-4-11-5/h1-4H,(H2,10,11,12) |
| InChI Key | RBVQDZHVLDPUFG-UHFFFAOYSA-N |
| MDL Number | MFCD16103567 |
| Molecular Formula | C8H6BrN3O |
| Molecular Weight | 240.0567 |
| SMILES | NC1=NC=NC(C2OC(Br)=CC=2)=C1 |
| Synonyms | 6-(5-bromofuran-2-yl)pyrimidin-4-amine,
1250891-98-5,
ZINC44262438,
AKOS011056894,
NE42159,
F8887-5376,
Z1918018424,
|
| Complexity | 181 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 238.969g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.06g/mol |
| Monoisotopic Mass | 238.969g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 64.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number