| CAS Number | 1221572-27-5 |
| Catalog Number | AG00ITN1(AGN-PC-0WAXVN) |
| Chemical Name | 2-Chloro-4,6-diiodo-3-methoxypyridine |
| IUPAC Name | 2-chloro-4,6-diiodo-3-methoxypyridine |
| InChI | InChI=1S/C6H4ClI2NO/c1-11-5-3(8)2-4(9)10-6(5)7/h2H,1H3 |
| InChI Key | KDGNLHUMFQGFJM-UHFFFAOYSA-N |
| MDL Number | MFCD14584792 |
| Molecular Formula | C6H4ClI2NO |
| Molecular Weight | 395.3640 |
| SMILES | ClC1=NC(=CC(=C1OC)I)I |
| Synonyms | 2-chloro-4,6-diiodo-3-methoxypyridine,
1221572-27-5,
chlorodiiodomethoxypyridine,
CTK6J4349,
ZX-RL002903,
MFCD14584792,
ZINC43827467,
AKOS005071623,
AE-0089,
FCH1385180,
RP17171,
KS-0000221F,
OR303653,
AJ-108791,
TR-070852,
|
| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 394.807g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 395.363g/mol |
| Monoisotopic Mass | 394.807g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 22.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
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Certificate of Analysis
Lot Number