| CAS Number | 39487-87-1 |
| Catalog Number | AG01BSS8 |
| Chemical Name | 4,8-dichloro-3-nitroquinoline |
| IUPAC Name | 4,8-dichloro-3-nitroquinoline |
| InChI | InChI=1S/C9H4Cl2N2O2/c10-6-3-1-2-5-8(11)7(13(14)15)4-12-9(5)6/h1-4H |
| InChI Key | RQECNHYTLTWCHW-UHFFFAOYSA-N |
| MDL Number | MFCD28955313 |
| Molecular Formula | C9H4Cl2N2O2 |
| Molecular Weight | 243.0463 |
| SMILES | [O-][N+](C1=C(Cl)C2=C(C(=CC=C2)Cl)N=C1)=O |
| Synonyms | 4,8-dichloro-3-nitroquinoline,
39487-87-1,
ZINC38954198,
4,8-dichloro-3-nitro-quinoline,
CID10490392,
|
| Complexity | 259 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.965g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 243.043g/mol |
| Monoisotopic Mass | 241.965g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 58.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number