| CAS Number | 1132843-09-4 |
| Catalog Number | AG01AP44 |
| Chemical Name | (3,3-Difluorocyclobutyl)methyl methanesulfonate |
| IUPAC Name | (3,3-difluorocyclobutyl)methyl methanesulfonate |
| InChI | InChI=1S/C6H10F2O3S/c1-12(9,10)11-4-5-2-6(7,8)3-5/h5H,2-4H2,1H3 |
| InChI Key | POJIPIRETMFFIV-UHFFFAOYSA-N |
| MDL Number | MFCD29034404 |
| Molecular Formula | C6H10F2O3S |
| Molecular Weight | 200.2036 |
| SMILES | CS(OCC1CC(F)(F)C1)(=O)=O |
| Synonyms | (3,3-difluorocyclobutyl)methyl methanesulfonate,
1132843-09-4,
SCHEMBL2796319,
POJIPIRETMFFIV-UHFFFAOYSA-N,
ZINC169082908,
AS-44100,
(3,3-Difluorocyclobutyl)methyl methanesulphonate,
|
| Complexity | 247 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.031872g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.21g/mol |
| Monoisotopic Mass | 200.031872g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.8Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
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