| CAS Number | 755758-89-5 |
| Catalog Number | AG00G71Q(AGN-PC-08XZEA) |
| Chemical Name | 1-Chloro-2-iodo-4,5-dimethylbenzene |
| IUPAC Name | 1-chloro-2-iodo-4,5-dimethylbenzene |
| InChI | InChI=1S/C8H8ClI/c1-5-3-7(9)8(10)4-6(5)2/h3-4H,1-2H3 |
| InChI Key | CWNHCFSPRUCSKI-UHFFFAOYSA-N |
| MDL Number | MFCD12922556 |
| Molecular Formula | C8H8ClI |
| Molecular Weight | 266.5066 |
| SMILES | ClC=1C=C(C(=CC1I)C)C |
| Synonyms | 1-Chloro-2-iodo-4,5-dimethylbenzene,
755758-89-5,
4-Chloro-5-iodo-o-xylene,
4-Iodo-5-chloro-o-xylene,
MFCD12922556,
ZINC66318846,
AKOS017560066,
DS-18688,
Benzene, 1-chloro-2-iodo-4,5-dimethyl-,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 265.936g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 0 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.506g/mol |
| Monoisotopic Mass | 265.936g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number