| CAS Number | 1315365-43-5 |
| Catalog Number | AG01AJFM(AGN-PC-0WO1DK) |
| Chemical Name | 2-Methyl-3-phenylthiomorpholine |
| IUPAC Name | 2-methyl-3-phenylthiomorpholine |
| InChI | InChI=1S/C11H15NS/c1-9-11(12-7-8-13-9)10-5-3-2-4-6-10/h2-6,9,11-12H,7-8H2,1H3 |
| InChI Key | YLKRSWDSQCVVGY-UHFFFAOYSA-N |
| MDL Number | MFCD19382271 |
| Molecular Formula | C11H15NS |
| Molecular Weight | 193.3085 |
| SMILES | CC1C(C2=CC=CC=C2)NCCS1 |
| Synonyms | 2-methyl-3-phenylthiomorpholine,
1315365-43-5,
AKOS013602740,
NE20113,
EN300-80607,
|
| Complexity | 154 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 193.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 193.308g/mol |
| Monoisotopic Mass | 193.093g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number