| CAS Number | 1803585-24-1 |
| Catalog Number | AG01ACII(AGN-PC-0WO43P) |
| Chemical Name | 2,2-diethylthiomorpholine |
| IUPAC Name | 2,2-diethylthiomorpholine |
| InChI | InChI=1S/C8H17NS/c1-3-8(4-2)7-9-5-6-10-8/h9H,3-7H2,1-2H3 |
| InChI Key | FYKUTAONPLFPCD-UHFFFAOYSA-N |
| MDL Number | MFCD26408006 |
| Molecular Formula | C8H17NS |
| Molecular Weight | 159.2923 |
| SMILES | CCC1(SCCNC1)CC |
| Synonyms | 2,2-diethylthiomorpholine,
1803585-24-1,
ZINC95829711,
AKOS026727422,
NE17218,
|
| Complexity | 99.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 159.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 159.291g/mol |
| Monoisotopic Mass | 159.108g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number