| CAS Number | 85356-68-9 |
| Catalog Number | AG008FGR(AGN-PC-02IPD2) |
| Chemical Name | 1-Bromo-4-(2-iodoethyl)benzene |
| IUPAC Name | 1-bromo-4-(2-iodoethyl)benzene |
| InChI | InChI=1S/C8H8BrI/c9-8-3-1-7(2-4-8)5-6-10/h1-4H,5-6H2 |
| InChI Key | HPDBQVCZDFTUOI-UHFFFAOYSA-N |
| MDL Number | MFCD08544557 |
| Molecular Formula | C8H8BrI |
| Molecular Weight | 310.9576 |
| SMILES | ICCC1=CC=C(Br)C=C1 |
| Synonyms | 1-Bromo-4-(2-iodoethyl)benzene,
85356-68-9,
Benzene,1-bromo-4-(2-iodoethyl)-,
SCHEMBL5645,
4-Bromo-2-iodoethyl benzene,
CTK5F4791,
DTXSID80599321,
4-(2-Iodoethyl)-1-bromobenzene,
HPDBQVCZDFTUOI-UHFFFAOYSA-N,
1-bromo-4-(2-iodo-ethyl)-benzene,
3237AC,
KM2314,
MFCD08544557,
ZINC74938026,
FCH1389304,
AS-38828,
AJ-121523,
AX8057441,
CS-0060220,
C8H8BrI,
|
| Complexity | 87.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 309.885g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.96g/mol |
| Monoisotopic Mass | 309.885g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number