| CAS Number | 23135-16-2 |
| Catalog Number | AG002MAD(AGN-PC-008F6H) |
| Chemical Name | 1-Chloro-4-(1,2-dibromoethyl)benzene |
| IUPAC Name | 1-chloro-4-(1,2-dibromoethyl)benzene |
| InChI | InChI=1S/C8H7Br2Cl/c9-5-8(10)6-1-3-7(11)4-2-6/h1-4,8H,5H2 |
| InChI Key | LBLPNCDPGCZTRP-UHFFFAOYSA-N |
| MDL Number | MFCD00634325 |
| Molecular Formula | C8H7Br2Cl |
| Molecular Weight | 298.4022 |
| SMILES | BrCC(c1ccc(cc1)Cl)Br |
| Synonyms | 1-Chloro-4-(1,2-dibromoethyl)benzene,
23135-16-2,
ACMC-20aovz,
SCHEMBL9370511,
CTK4F0937,
DTXSID90464874,
AKOS025294956,
1-(1,2-Dibromoethyl)-4-chlorobenzene,
Benzene,1-chloro-4-(1,2-dibromoethyl)-,
Benzene, 1-chloro-4-(1,2-dibromoethyl)-,
TC-171926,
1-Chloro-4-(1,2-dibromoethyl)benzene, 97%,
CID11403793,
|
| Complexity | 111 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 297.858g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 298.402g/mol |
| Monoisotopic Mass | 295.86g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
9
|
|
Hazard statements
|
H315-H319-H335
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P261-P305+P351+P338
|
|
UN Code
|
UN 3077
|
Certificate of Analysis
Lot Number