| CAS Number | 1070879-40-1 |
| Catalog Number | AG007TFU(AGN-PC-05T2XA) |
| Chemical Name | 4-Bromo-7,8-dichloroquinoline |
| IUPAC Name | 4-bromo-7,8-dichloroquinoline |
| InChI | InChI=1S/C9H4BrCl2N/c10-6-3-4-13-9-5(6)1-2-7(11)8(9)12/h1-4H |
| InChI Key | HCKYNTRWPZIEGM-UHFFFAOYSA-N |
| MDL Number | MFCD11505123 |
| Molecular Formula | C9H4BrCl2N |
| Molecular Weight | 276.9448 |
| SMILES | Clc1ccc2c(c1Cl)nccc2Br |
| Synonyms | 4-Bromo-7,8-dichloroquinoline,
1070879-40-1,
CTK4A4969,
DTXSID30653689,
MFCD11505123,
ZINC32099855,
DB-059553,
RT-016953,
FT-0748133,
T6140,
|
| 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 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number