| CAS Number | 1345447-25-7 |
| Catalog Number | AG01A5D4(AGN-PC-0WO8ZG) |
| Chemical Name | 4-Chloro-6-iodo-3-nitroquinoline |
| IUPAC Name | 4-chloro-6-iodo-3-nitroquinoline |
| InChI | InChI=1S/C9H4ClIN2O2/c10-9-6-3-5(11)1-2-7(6)12-4-8(9)13(14)15/h1-4H |
| InChI Key | LKZNJZYVZCFISW-UHFFFAOYSA-N |
| MDL Number | MFCD24369278 |
| Molecular Formula | C9H4ClIN2O2 |
| Molecular Weight | 334.4977 |
| SMILES | [O-][N+](C1=C(Cl)C2=C(C=CC(=C2)I)N=C1)=O |
| Synonyms | 4-chloro-6-iodo-3-nitroquinoline,
1345447-25-7,
SCHEMBL2597703,
LKZNJZYVZCFISW-UHFFFAOYSA-N,
4-chloro-6-iodo-3-nitro-quinoline,
ZINC95221090,
AKOS026728982,
|
| Complexity | 261 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 333.901g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 334.497g/mol |
| Monoisotopic Mass | 333.901g/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