| CAS Number | 2059975-69-6 |
| Catalog Number | AG01BRDR |
| Chemical Name | 3-(Iodomethyl)-2,8-dioxaspiro[4.5]decane |
| IUPAC Name | 3-(iodomethyl)-2,8-dioxaspiro[4.5]decane |
| InChI | InChI=1S/C9H15IO2/c10-6-8-5-9(7-12-8)1-3-11-4-2-9/h8H,1-7H2 |
| InChI Key | WZNBEHGZGXJKHT-UHFFFAOYSA-N |
| MDL Number | MFCD30502484 |
| Molecular Formula | C9H15IO2 |
| Molecular Weight | 282.1187 |
| SMILES | ICC1OCC2(CCOCC2)C1 |
| Synonyms | 3-(iodomethyl)-2,8-dioxaspiro[4.5]decane,
2059975-69-6,
|
| Complexity | 155 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 282.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 282.121g/mol |
| Monoisotopic Mass | 282.012g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number