| CAS Number | 623168-99-0 |
| Catalog Number | AG00IB0F(AGN-PC-0T3VS1) |
| Chemical Name | (S)-N-[(1E)-Ethylidene]-2-methylpropane-2-sulfinamide |
| IUPAC Name | (S)-N-ethylidene-2-methylpropane-2-sulfinamide |
| InChI | InChI=1S/C6H13NOS/c1-5-7-9(8)6(2,3)4/h5H,1-4H3/t9-/m0/s1 |
| InChI Key | SFPPCFXOSJAOKL-VIFPVBQESA-N |
| MDL Number | MFCD18781421 |
| Molecular Formula | C6H13NOS |
| Molecular Weight | 147.2385 |
| SMILES | C/C=N/[S@](C(C)(C)C)=O |
| Synonyms | (S)-N-[(1E)-ethylidene]-2-methylpropane-2-sulfinamide,
623168-99-0,
SFPPCFXOSJAOKL-IWGCBNPKSA-N,
ZINC34538681,
AKOS030242738,
KS-000025J5,
(S,E)-N-ethylidene-2-methylpropane-2-sulfinamide,
(S)-2-methyl-propane-2-sulfinic acid (E)-ethylideneamide,
|
| Complexity | 135 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.236g/mol |
| Monoisotopic Mass | 147.072g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 48.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 0.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number