| CAS Number | 20981-79-7 |
| Catalog Number | AG002KFZ(AGN-PC-00PH26) |
| Chemical Name | 3,5-Diiodophenol |
| IUPAC Name | 3,5-diiodophenol |
| InChI | InChI=1S/C6H4I2O/c7-4-1-5(8)3-6(9)2-4/h1-3,9H |
| InChI Key | KYRNAIDRKAWDLJ-UHFFFAOYSA-N |
| MDL Number | MFCD12405421 |
| Molecular Formula | C6H4I2O |
| Molecular Weight | 345.9043 |
| SMILES | OC1=CC(I)=CC(I)=C1 |
| Synonyms | 3,5-DIIODOPHENOL,
20981-79-7,
Phenol, 3,5-diiodo-,
SCHEMBL1687060,
CTK4E5597,
DTXSID80573449,
0730AB,
ANW-67837,
ZINC34574148,
AKOS016007210,
MB11867,
AJ-89430,
TC-156582,
FT-0729357,
C6H4I2O,
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| Complexity | 87.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 345.835g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 345.906g/mol |
| Monoisotopic Mass | 345.835g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 20.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.9 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number