| CAS Number | 87293-40-1 |
| Catalog Number | AG019MI6(AGN-PC-0WO6EF) |
| Chemical Name | 8-(Bromomethyl)-6-chloroquinoline |
| IUPAC Name | 8-(bromomethyl)-6-chloroquinoline |
| InChI | InChI=1S/C10H7BrClN/c11-6-8-5-9(12)4-7-2-1-3-13-10(7)8/h1-5H,6H2 |
| InChI Key | IVSVEUFMSNAINT-UHFFFAOYSA-N |
| MDL Number | MFCD09049765 |
| Molecular Formula | C10H7BrClN |
| Molecular Weight | 256.5263 |
| SMILES | ClC1=CC2=C(N=CC=C2)C(CBr)=C1 |
| Synonyms | 8-(bromomethyl)-6-chloroquinoline,
87293-40-1,
Quinoline, 8-(bromomethyl)-6-chloro-,
AC1Q3KKU,
SCHEMBL10880120,
CTK5I9756,
ZINC20283500,
AKOS000133121,
MCULE-7255230353,
SC-34347,
EN300-36285,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.945g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 256.527g/mol |
| Monoisotopic Mass | 254.945g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number