| CAS Number | 885681-96-9 |
| Catalog Number | AG00IF7K(AGN-PC-09O3EV) |
| Chemical Name | Benzene, 4-bromo-1-(bromomethyl)-2-iodo- |
| IUPAC Name | 4-bromo-1-(bromomethyl)-2-iodobenzene |
| InChI | InChI=1S/C7H5Br2I/c8-4-5-1-2-6(9)3-7(5)10/h1-3H,4H2 |
| InChI Key | IHHHQROJDZQCQH-UHFFFAOYSA-N |
| MDL Number | MFCD18391672 |
| Molecular Formula | C7H5Br2I |
| Molecular Weight | 375.8271 |
| SMILES | BrC1=CC(=C(CBr)C=C1)I |
| Synonyms | 4-BROMO-2-IODOBENZYL BROMIDE,
885681-96-9,
4-bromo-1-(bromomethyl)-2-iodobenzene,
Benzene, 4-bromo-1-(bromomethyl)-2-iodo-,
SCHEMBL28419,
2-Iodo-4-bromobenzyl bromide,
IHHHQROJDZQCQH-UHFFFAOYSA-N,
2-Iodo-4-bromo(bromomethyl)benzene,
ZX-AT013225,
MFCD18391672,
ZINC91302721,
FCH1369998,
OR40663,
AK677333,
AM804742,
DS-20040,
SC-52675,
CS-0040964,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 375.778g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 375.829g/mol |
| Monoisotopic Mass | 373.78g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
8
|
|
Hazard statements
|
H314
|
|
Packing Group
|
Ⅱ
|
|
Precautionary statements
|
P280-P305+P351+P338-P310
|
|
UN Code
|
UN 3261
|
Certificate of Analysis
Lot Number