| CAS Number | 1516805-43-8 |
| Catalog Number | AG01CADP |
| Chemical Name | 2-Bromo-5-(prop-1-en-2-yl)pyridine |
| IUPAC Name | 2-bromo-5-prop-1-en-2-ylpyridine |
| InChI | InChI=1S/C8H8BrN/c1-6(2)7-3-4-8(9)10-5-7/h3-5H,1H2,2H3 |
| InChI Key | TUVPZXKIBHJGEV-UHFFFAOYSA-N |
| MDL Number | MFCD28130170 |
| Molecular Formula | C8H8BrN |
| Molecular Weight | 198.0598 |
| SMILES | CC(C1=CN=C(Br)C=C1)=C |
| Synonyms | 2-Bromo-5-(prop-1-en-2-yl)pyridine,
1516805-43-8,
SCHEMBL5700551,
TUVPZXKIBHJGEV-UHFFFAOYSA-N,
ZINC141957449,
Pyridine, 2-bromo-5-(1-methylethenyl)-,
FT-0727505,
2-bromo-5-(1-methylethenyl)Pyridine,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 196.984g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.063g/mol |
| Monoisotopic Mass | 196.984g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number