| CAS Number | 75646-22-9 |
| Catalog Number | AG005ANM(AGN-PC-0JDYXL) |
| Chemical Name | Cycloheptylmethyl methanesulfonate |
| IUPAC Name | cycloheptylmethyl methanesulfonate |
| InChI | InChI=1S/C9H18O3S/c1-13(10,11)12-8-9-6-4-2-3-5-7-9/h9H,2-8H2,1H3 |
| InChI Key | SBBZAZOOOJEDAR-UHFFFAOYSA-N |
| MDL Number | MFCD24843027 |
| Molecular Formula | C9H18O3S |
| Molecular Weight | 206.3024 |
| SMILES | CS(OCC1CCCCCC1)(=O)=O |
| Synonyms | cycloheptylmethyl methanesulfonate,
75646-22-9,
methane-sulphonyloxymethylcycloheptane,
cycloheptylmethyl methansulfonate,
SCHEMBL1710596,
SBBZAZOOOJEDAR-UHFFFAOYSA-N,
Methanesulphonyloxymethylcycloheptane,
MFCD24843027,
ZINC95347945,
Cycloheptanemethanol,1-methansulfonate,
AKOS026726583,
NE54627,
SC-60819,
cycloheptylmethanol,methanesulfonic acid,
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| Complexity | 220 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 206.098g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.3g/mol |
| Monoisotopic Mass | 206.098g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number