| CAS Number | 1070879-38-7 |
| Catalog Number | AG007B6C(AGN-PC-05T2X8) |
| Chemical Name | 4-Bromo-5,8-dichloroquinoline |
| IUPAC Name | 4-bromo-5,8-dichloroquinoline |
| InChI | InChI=1S/C9H4BrCl2N/c10-5-3-4-13-9-7(12)2-1-6(11)8(5)9/h1-4H |
| InChI Key | IUDIYVBYMWRXDM-UHFFFAOYSA-N |
| MDL Number | MFCD11505120 |
| Molecular Formula | C9H4BrCl2N |
| Molecular Weight | 276.9448 |
| SMILES | Clc1ccc(c2c1c(Br)ccn2)Cl |
| Synonyms | 4-Bromo-5,8-dichloroquinoline,
1070879-38-7,
CTK4A4967,
DTXSID10653687,
MFCD11505120,
ZINC32099852,
DB-059551,
RT-016913,
FT-0723001,
T6139,
|
| Complexity | 191 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.89g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 276.942g/mol |
| Monoisotopic Mass | 274.89g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.1 |
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Certificate of Analysis
Lot Number