| CAS Number | 62319-13-5 |
| Catalog Number | AG00EEJ9(AGN-PC-0T3WNZ) |
| Chemical Name | Methyl (1S)-(+)-10-Camphorsulfonate |
| IUPAC Name | methyl [(1S,4R)-7,7-dimethyl-2-oxo-1-bicyclo[2.2.1]heptanyl]methanesulfonate |
| InChI | InChI=1S/C11H18O4S/c1-10(2)8-4-5-11(10,9(12)6-8)7-16(13,14)15-3/h8H,4-7H2,1-3H3/t8-,11-/m1/s1 |
| InChI Key | PIZJIRRXGXBJAU-LDYMZIIASA-N |
| MDL Number | MFCD29045182 |
| Molecular Formula | C11H18O4S |
| Molecular Weight | 246.3232 |
| SMILES | O=S(C[C@@]1(C2(C)C)C(C[C@@]2([H])CC1)=O)(OC)=O |
| Synonyms | 62319-13-5,
Methyl (1S)-(+)-10-Camphorsulfonate,
Methyl ((1S,4R)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl)methanesulfonate,
methyl [(1S,4R)-7,7-dimethyl-2-oxobicyclo[2.2.1]heptan-1-yl]methanesulfonate,
ZINC32134901,
AKOS027323971,
[(1S,4R)-7,7-Dimethyl-2-oxobicyclo[2.2.1]heptane-1-yl]methanesulfonic acid methyl ester,
D-camphorsulfonic acid methyl ester,
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| Complexity | 418 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 246.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.321g/mol |
| Monoisotopic Mass | 246.093g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 68.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number