| CAS Number | 88474-19-5 |
| Catalog Number | AG004AAY(AGN-PC-00L64O) |
| Chemical Name | 8-(Bromomethyl)-5-chloroquinoline |
| IUPAC Name | 8-(bromomethyl)-5-chloroquinoline |
| InChI | InChI=1S/C10H7BrClN/c11-6-7-3-4-9(12)8-2-1-5-13-10(7)8/h1-5H,6H2 |
| InChI Key | HZXCAZDTKZDBLK-UHFFFAOYSA-N |
| MDL Number | MFCD09043816 |
| Molecular Formula | C10H7BrClN |
| Molecular Weight | 256.5263 |
| SMILES | ClC1=C2C(N=CC=C2)=C(CBr)C=C1 |
| Synonyms | 8-(bromomethyl)-5-chloroquinoline,
88474-19-5,
Quinoline, 8-(bromomethyl)-5-chloro-,
ACMC-20laan,
AC1Q3HXD,
CTK3B0980,
DTXSID30522381,
ZINC21956278,
AKOS000127864,
NE14153,
SC-34834,
EN300-39738,
N/A,
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| 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
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Certificate of Analysis
Lot Number