| CAS Number | 29442-12-4 |
| Catalog Number | AG00O7MM(AGN-PC-0WBPR5) |
| Chemical Name | 2,3-Dimethylthiomorpholine |
| IUPAC Name | 2,3-dimethylthiomorpholine |
| InChI | InChI=1S/C6H13NS/c1-5-6(2)8-4-3-7-5/h5-7H,3-4H2,1-2H3 |
| InChI Key | OSKSVESWLSCULX-UHFFFAOYSA-N |
| MDL Number | MFCD19218941 |
| Molecular Formula | C6H13NS |
| Molecular Weight | 131.2391 |
| SMILES | CC1C(C)SCCN1 |
| Synonyms | 2,3-dimethylthiomorpholine,
29442-12-4,
2,3-Dimethylthiomorpholin,
SCHEMBL11832985,
AKOS006356745,
NE25055,
2,3-Dimethylthiomorpholine, AldrichCPR,
EN300-80665,
F8880-2288,
|
| Complexity | 74.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 131.077g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 131.237g/mol |
| Monoisotopic Mass | 131.077g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number