| CAS Number | 2044706-06-9 |
| Catalog Number | AG00ILC2(AGN-PC-0WG3HB) |
| Chemical Name | 5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrobromide |
| IUPAC Name | 5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-amine;hydrobromide |
| InChI | InChI=1S/C6H5BrN4.BrH/c7-3-1-9-6-4(3)5(8)10-2-11-6;/h1-2H,(H3,8,9,10,11);1H |
| InChI Key | DOCPZLCXVDJNAT-UHFFFAOYSA-N |
| MDL Number | MFCD30489058 |
| Molecular Formula | C6H6Br2N4 |
| Molecular Weight | 293.9466 |
| SMILES | Br.Nc1ncnc2[nH]cc(Br)c12 |
| Synonyms | 5-bromo-7H-pyrrolo[2,3-d]pyrimidin-4-amine hydrobromide,
2044706-06-9,
5-Bromo-1H-pyrrolo[2,3-d]pyrimidin-4-amine hydrobromide,
CS-0050568,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.894g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.95g/mol |
| Monoisotopic Mass | 291.896g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 67.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number