| CAS Number | 1261671-12-8 |
| Catalog Number | AG009JUN(AGN-PC-0WR1Y6) |
| Chemical Name | 2-Chloro-5-iodo-benzylchloride |
| IUPAC Name | 1-chloro-2-(chloromethyl)-4-iodobenzene |
| InChI | InChI=1S/C7H5Cl2I/c8-4-5-3-6(10)1-2-7(5)9/h1-3H,4H2 |
| InChI Key | FTEZTINTXWCTDQ-UHFFFAOYSA-N |
| MDL Number | MFCD18393372 |
| Molecular Formula | C7H5Cl2I |
| Molecular Weight | 286.9251 |
| SMILES | ClC1=C(C=C(C=C1)I)CCl |
| Synonyms | 2-Chloro-5-iodobenzyl chloride,
1261671-12-8,
2-Chloro-5-iodo-benzylchloride,
1-CHLORO-2-(CHLOROMETHYL)-4-IODOBENZENE,
MFCD18393372,
ZINC79069455,
AS05957,
CM13324,
BC662638,
BENZENE, 1-CHLORO-2-(CHLOROMETHYL)-4-IODO-,
|
| Complexity | 108 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 285.881g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.921g/mol |
| Monoisotopic Mass | 285.881g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number