| CAS Number | 1566171-98-9 |
| Catalog Number | AG01B3IU |
| Chemical Name | ((3r,5r,7r)-adamantan-1-yl)methanesulfonyl chloride |
| IUPAC Name | 1-adamantylmethanesulfonyl chloride |
| InChI | InChI=1S/C11H17ClO2S/c12-15(13,14)7-11-4-8-1-9(5-11)3-10(2-8)6-11/h8-10H,1-7H2 |
| InChI Key | GBKHUYXWTUXLBQ-UHFFFAOYSA-N |
| MDL Number | MFCD26064591 |
| Molecular Formula | C11H17ClO2S |
| Molecular Weight | 248.7695 |
| SMILES | ClS(CC12CC3CC(C1)CC(C3)C2)(=O)=O |
| Synonyms | (adamantan-1-yl)methanesulfonyl chloride,
1566171-98-9,
|
| Complexity | 327 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 248.064g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 248.765g/mol |
| Monoisotopic Mass | 248.064g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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Lot Number