| CAS Number | 948294-46-0 |
| Catalog Number | AG005V1L(AGN-PC-01A9IW) |
| Chemical Name | 2-Chloro-3-(2-chloroethyl)-6-bromoquinoline |
| IUPAC Name | 6-bromo-2-chloro-3-(2-chloroethyl)quinoline |
| InChI | InChI=1S/C11H8BrCl2N/c12-9-1-2-10-8(6-9)5-7(3-4-13)11(14)15-10/h1-2,5-6H,3-4H2 |
| InChI Key | HXRISNDQRQVHSH-UHFFFAOYSA-N |
| MDL Number | MFCD09787617 |
| Molecular Formula | C11H8BrCl2N |
| Molecular Weight | 304.9979 |
| SMILES | Clc1nc2ccc(cc2cc1CCCl)Br |
| Synonyms | 2-Chloro-3-(2-chloroethyl)-6-bromoquinoline,
948294-46-0,
6-bromo-2-chloro-3-(2-chloroethyl)quinoline,
CTK8E3849,
DTXSID50588944,
MFCD09787617,
ZINC32099339,
AKOS027313829,
AB51815,
OR307894,
DB-080106,
RT-007542,
FT-0737412,
T6831,
2-Chloro-3-(2-chloroethyl)-6-bromoquinoline, AldrichCPR,
|
| Complexity | 215 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 302.922g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 304.996g/mol |
| Monoisotopic Mass | 302.922g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 12.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number