| CAS Number | 1849359-21-2 |
| Catalog Number | AG01BU7P |
| Chemical Name | 6-(iodomethyl)-5-oxaspiro[3.4]octane |
| IUPAC Name | 6-(iodomethyl)-5-oxaspiro[3.4]octane |
| InChI | InChI=1S/C8H13IO/c9-6-7-2-5-8(10-7)3-1-4-8/h7H,1-6H2 |
| InChI Key | VMYZCPNTCWXXOX-UHFFFAOYSA-N |
| MDL Number | MFCD30724034 |
| Molecular Formula | C8H13IO |
| Molecular Weight | 252.0927 |
| SMILES | ICC1OC2(CCC2)CC1 |
| Synonyms | 6-(iodomethyl)-5-oxaspiro[3.4]octane,
1849359-21-2,
|
| Complexity | 131 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 252.001g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 252.095g/mol |
| Monoisotopic Mass | 252.001g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number