| CAS Number | 76225-97-3 |
| Catalog Number | AG01B6XA |
| Chemical Name | 2-iodopropanedial |
| IUPAC Name | 2-iodopropanedial |
| InChI | InChI=1S/C3H3IO2/c4-3(1-5)2-6/h1-3H |
| InChI Key | CTDBHYCWOSCODO-UHFFFAOYSA-N |
| MDL Number | MFCD12923234 |
| Molecular Formula | C3H3IO2 |
| Molecular Weight | 197.9592 |
| SMILES | IC(C=O)C=O |
| Synonyms | 2-iodopropanedial,
76225-97-3,
iodomalonaldehyde,
(Z)-3-hydroxy-2-iodoacrolein,
SCHEMBL10696724,
ZINC138845395,
29548-74-1,
|
| Complexity | 53.8 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.918g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 6 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.959g/mol |
| Monoisotopic Mass | 197.918g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 34.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number