| CAS Number | 1086382-07-1 |
| Catalog Number | AG01AINE |
| Chemical Name | 4-Bromo-6-ethylpyrimidine |
| IUPAC Name | 4-bromo-6-ethylpyrimidine |
| InChI | InChI=1S/C6H7BrN2/c1-2-5-3-6(7)9-4-8-5/h3-4H,2H2,1H3 |
| InChI Key | BJPKKMIQIUTWKO-UHFFFAOYSA-N |
| MDL Number | MFCD11223260 |
| Molecular Formula | C6H7BrN2 |
| Molecular Weight | 187.0372 |
| SMILES | CCC1=NC=NC(Br)=C1 |
| Synonyms | 4-bromo-6-ethylpyrimidine,
1086382-07-1,
SCHEMBL16030878,
ZINC40765267,
AKOS010490238,
MB09510,
MCULE-3135795341,
EN300-78440,
F8889-6624,
Z1575304369,
|
| Complexity | 87.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 185.979g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.04g/mol |
| Monoisotopic Mass | 185.979g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 25.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number