| CAS Number | 945470-04-2 |
| Catalog Number | AG01EZJO(AGN-PC-3H48JM) |
| Chemical Name | 2-Chloro-1-iodo-3-methoxybenzene |
| IUPAC Name | 2-chloro-1-iodo-3-methoxybenzene |
| InChI | InChI=1S/C7H6ClIO/c1-10-6-4-2-3-5(9)7(6)8/h2-4H,1H3 |
| InChI Key | KXOUIZYSLOPGME-UHFFFAOYSA-N |
| MDL Number | MFCD18393314 |
| Molecular Formula | C7H6ClIO |
| Molecular Weight | 268.4794 |
| SMILES | COC1=CC=CC(I)=C1Cl |
| Synonyms | 2-chloro-1-iodo-3-methoxybenzene,
2-CHLORO-3-IODOANISOLE,
945470-04-2,
2-chloroiodoanisole,
SCHEMBL4619216,
KXOUIZYSLOPGME-UHFFFAOYSA-N,
ZINC96024745,
AS03053,
|
| Complexity | 110 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.915g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.478g/mol |
| Monoisotopic Mass | 267.915g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number