| CAS Number | 2091597-91-8 |
| Catalog Number | AG01BTMX |
| Chemical Name | {7-oxabicyclo[2.2.1]heptan-1-yl}methanesulfonyl chloride |
| IUPAC Name | 7-oxabicyclo[2.2.1]heptan-1-ylmethanesulfonyl chloride |
| InChI | InChI=1S/C7H11ClO3S/c8-12(9,10)5-7-3-1-6(11-7)2-4-7/h6H,1-5H2 |
| InChI Key | AKLYVJZGAHCKOA-UHFFFAOYSA-N |
| MDL Number | MFCD30730611 |
| Molecular Formula | C7H11ClO3S |
| Molecular Weight | 210.6784 |
| SMILES | ClS(CC12OC(CC1)CC2)(=O)=O |
| Synonyms | {7-oxabicyclo[2.2.1]heptan-1-yl}methanesulfonyl chloride,
2091597-91-8,
|
| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.672g/mol |
| Monoisotopic Mass | 210.012g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
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