| CAS Number | 224429-98-5 |
| Catalog Number | AG00I4FJ(AGN-PC-0WOHIP) |
| Chemical Name | 5-Bromo-4-ethyl-3,4-dihydropyrimidine |
| IUPAC Name | 5-bromo-4-ethyl-1,4-dihydropyrimidine |
| InChI | InChI=1S/C6H9BrN2/c1-2-6-5(7)3-8-4-9-6/h3-4,6H,2H2,1H3,(H,8,9) |
| InChI Key | SATOWWCSWKAUNO-UHFFFAOYSA-N |
| MDL Number | MFCD20681885 |
| Molecular Formula | C6H9BrN2 |
| Molecular Weight | 189.0531 |
| SMILES | CCC1NC=NC=C1Br |
| Synonyms | 5-Bromo-4-ethyl-3,4-dihydropyrimidine,
224429-98-5,
AKOS026673621,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.995g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.056g/mol |
| Monoisotopic Mass | 187.995g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 24.4A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number