| CAS Number | 1204812-01-0 |
| Catalog Number | AG00934P(AGN-PC-0WR1NM) |
| Chemical Name | 3,8-Dibromo-4-hydroxyquinoline |
| IUPAC Name | 3,8-dibromo-1H-quinolin-4-one |
| InChI | InChI=1S/C9H5Br2NO/c10-6-3-1-2-5-8(6)12-4-7(11)9(5)13/h1-4H,(H,12,13) |
| InChI Key | GEOSMWHTWPLBPB-UHFFFAOYSA-N |
| MDL Number | MFCD13192874 |
| Molecular Formula | C9H5Br2NO |
| Molecular Weight | 302.9501 |
| SMILES | BrC=1C=NC2=C(C=CC=C2C1O)Br |
| Synonyms | 3,8-Dibromo-4-hydroxyquinoline,
1204812-01-0,
3,8-Dibromoquinolin-4(1H)-one,
DTXSID50671087,
MFCD13192874,
ZINC41702032,
OR309325,
3,8-Dibromo-4-hydroxyquinoline, AldrichCPR,
T6290,
|
| Complexity | 264 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 302.872g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 302.953g/mol |
| Monoisotopic Mass | 300.874g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number