| CAS Number | 64923-60-0 |
| Catalog Number | AG00IBFB(AGN-PC-0OEZDI) |
| Chemical Name | 2-ETHYLPROPANE-1,3-DIYL DIMETHANESULFONATE |
| IUPAC Name | 2-(methylsulfonyloxymethyl)butyl methanesulfonate |
| InChI | InChI=1S/C7H16O6S2/c1-4-7(5-12-14(2,8)9)6-13-15(3,10)11/h7H,4-6H2,1-3H3 |
| InChI Key | PINZPBHJCPSYTN-UHFFFAOYSA-N |
| MDL Number | MFCD14635836 |
| Molecular Formula | C7H16O6S2 |
| Molecular Weight | 260.3283 |
| NSC Number | 513150 |
| SMILES | CCC(COS(=O)(=O)C)COS(=O)(=O)C |
| Synonyms | 2-Ethylpropane-1,3-diyl dimethanesulfonate,
64923-60-0,
2-(methylsulfonyloxymethyl)butyl methanesulfonate,
NSC513150,
AC1L6WLR,
SCHEMBL9343626,
DTXSID70325616,
ZINC1603660,
MFCD14635836,
AKOS030627597,
NSC-513150,
CID350609,
|
| Complexity | 321 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 260.039g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 260.319g/mol |
| Monoisotopic Mass | 260.039g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number