| CAS Number | 74694-50-1 |
| Catalog Number | AG008PEI(AGN-PC-0NJEN3) |
| Chemical Name | 4-(Iodomethyl)azetidin-2-one |
| IUPAC Name | 4-(iodomethyl)azetidin-2-one |
| InChI | InChI=1S/C4H6INO/c5-2-3-1-4(7)6-3/h3H,1-2H2,(H,6,7) |
| InChI Key | QHSNSUAFJJIIQW-UHFFFAOYSA-N |
| MDL Number | MFCD00206300 |
| Molecular Formula | C4H6INO |
| Molecular Weight | 211.0010 |
| SMILES | ICC1CC(=O)N1 |
| Synonyms | 4-(iodomethyl)azetidin-2-one,
74694-50-1,
2-Azetidinone, 4-(iodomethyl)-,
SCHEMBL6692850,
CTK2G9850,
DTXSID20502576,
MFCD00206300,
FCH1642647,
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| Complexity | 93.7 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.949g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 211.002g/mol |
| Monoisotopic Mass | 210.949g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number