| CAS Number | 904369-20-6 |
| Catalog Number | AG00H341(AGN-PC-0WOAOZ) |
| Chemical Name | 7-Bromoquinoline-2-Carbaldehyde |
| IUPAC Name | 7-bromoquinoline-2-carbaldehyde |
| InChI | InChI=1S/C10H6BrNO/c11-8-3-1-7-2-4-9(6-13)12-10(7)5-8/h1-6H |
| InChI Key | UAAIYUWCJFTSAF-UHFFFAOYSA-N |
| MDL Number | MFCD06824224 |
| Molecular Formula | C10H6BrNO |
| Molecular Weight | 236.0647 |
| SMILES | BrC1=CC2=C(C=CC(=N2)C=O)C=C1 |
| Synonyms | 7-bromoquinoline-2-carbaldehyde,
904369-20-6,
7-bromo-quinoline-2-carbaldehyde,
SCHEMBL2016701,
UAAIYUWCJFTSAF-UHFFFAOYSA-N,
ZINC1526707,
2-Quinolinecarboxaldehyde, 7-bromo-,
3691AJ,
AKOS022493796,
Z-7301,
C10H6BrNO,
7-bromo-2-Quinolinecarboxaldehyde,
|
| Complexity | 197 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.963g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 236.068g/mol |
| Monoisotopic Mass | 234.963g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 30A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number