| CAS Number | 1208077-39-7 |
| Catalog Number | AG01C35Q |
| Chemical Name | 3,6-Difluoro-2-iodobenzaldehyde |
| IUPAC Name | 3,6-difluoro-2-iodobenzaldehyde |
| InChI | InChI=1S/C7H3F2IO/c8-5-1-2-6(9)7(10)4(5)3-11/h1-3H |
| InChI Key | VOXSOTQNNPOFRB-UHFFFAOYSA-N |
| MDL Number | MFCD12922617 |
| Molecular Formula | C7H3F2IO |
| Molecular Weight | 267.9994 |
| SMILES | c1(ccc(c(c1I)C=O)F)F |
| Synonyms | 3,6-difluoro-2-iodobenzaldehyde,
1208077-39-7,
2-Iodo-3,6-difluorobenzaldehyde,
ZINC40571913,
N/A,
|
| Complexity | 153 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 267.92g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.001g/mol |
| Monoisotopic Mass | 267.92g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number