| CAS Number | 162936-38-1 |
| Catalog Number | AG01AM16 |
| Chemical Name | 4-(Prop-2-yn-1-yl)thiomorpholine |
| IUPAC Name | 4-prop-2-ynylthiomorpholine |
| InChI | InChI=1S/C7H11NS/c1-2-3-8-4-6-9-7-5-8/h1H,3-7H2 |
| InChI Key | GNOZQMPJMYZMIV-UHFFFAOYSA-N |
| MDL Number | MFCD14631773 |
| Molecular Formula | C7H11NS |
| Molecular Weight | 141.2339 |
| SMILES | C#CCN1CCSCC1 |
| Synonyms | 4-(prop-2-yn-1-yl)thiomorpholine,
162936-38-1,
3-(4-thiomorpholinyl)-1-propyne,
SCHEMBL5500691,
ZINC38864487,
AKOS010195543,
Z644486968,
4-prop-2-ynylthiomorpholine,
CID10441792,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.232g/mol |
| Monoisotopic Mass | 141.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 28.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number