| CAS Number | 996-86-1 |
| Catalog Number | AG01A281(AGN-PC-03P6SD) |
| Chemical Name | N,N-diethyl-2-sulfanylacetamide |
| IUPAC Name | N,N-diethyl-2-sulfanylacetamide |
| InChI | InChI=1S/C6H13NOS/c1-3-7(4-2)6(8)5-9/h9H,3-5H2,1-2H3 |
| InChI Key | ITXZOMWPESGFSN-UHFFFAOYSA-N |
| MDL Number | MFCD21273671 |
| Molecular Formula | C6H13NOS |
| Molecular Weight | 147.2385 |
| SMILES | CCN(C(CS)=O)CC |
| Synonyms | N,N-diethyl-2-sulfanylacetamide,
996-86-1,
SCHEMBL3905585,
ZINC81139135,
AKOS014966715,
NE20062,
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| Complexity | 91.1 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.072g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.236g/mol |
| Monoisotopic Mass | 147.072g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number