| CAS Number | 3970-88-5 |
| Catalog Number | AG00D048(AGN-PC-0033NA) |
| Chemical Name | 2-Methylthiomorpholine |
| IUPAC Name | 2-methylthiomorpholine |
| InChI | InChI=1S/C5H11NS/c1-5-4-6-2-3-7-5/h5-6H,2-4H2,1H3 |
| InChI Key | MHHCLPHGZOISFK-UHFFFAOYSA-N |
| MDL Number | MFCD11137727 |
| Molecular Formula | C5H11NS |
| Molecular Weight | 117.2125 |
| SMILES | CC1SCCNC1 |
| Synonyms | 2-methylthiomorpholine,
Thiomorpholine, 2-methyl-,
3970-88-5,
(2R)-2-Methylthiomorpholine,
911306-98-4,
2-Methylthiomorpholin,
AC1Q2RGL,
Thiomorpholine,2-methyl-,
SCHEMBL1099053,
CTK8F4441,
MHHCLPHGZOISFK-UHFFFAOYSA-N,
2-Methylthiomorpholine, AldrichCPR,
AKOS000223781,
AKOS016904552,
MCULE-7391261862,
NE21494,
EN300-69333,
|
| Complexity | 56 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 117.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 117.21g/mol |
| Monoisotopic Mass | 117.061g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number