| CAS Number | 17236-18-9 |
| Catalog Number | AG019OMW |
| Chemical Name | 1,1-dioxo-1lambda6-thiolane-3-carbohydrazide |
| IUPAC Name | 1,1-dioxothiolane-3-carbohydrazide |
| InChI | InChI=1S/C5H10N2O3S/c6-7-5(8)4-1-2-11(9,10)3-4/h4H,1-3,6H2,(H,7,8) |
| InChI Key | YHRCALKARIMHPT-UHFFFAOYSA-N |
| MDL Number | MFCD07344331 |
| Molecular Formula | C5H10N2O3S |
| Molecular Weight | 178.2095 |
| SMILES | NNC(C1CS(=O)(=O)CC1)=O |
| Synonyms | tetrahydrothiophene-3-carbohydrazide 1,1-dioxide,
17236-18-9,
1,1-dioxo-1lambda6-thiolane-3-carbohydrazide,
AC1Q54WD,
SCHEMBL19550422,
CTK7F0694,
HMS1772D22,
AKOS000118226,
AKOS017277874,
MCULE-9581927713,
NE30146,
1,1-dioxo-1??-thiolane-3-carbohydrazide,
1,1-dioxo-1lambda-thiolane-3-carbohydrazide,
EN300-14561,
Z104343030,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 178.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 178.206g/mol |
| Monoisotopic Mass | 178.041g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 97.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number