| CAS Number | 1565108-36-2 |
| Catalog Number | AG01BI99 |
| Chemical Name | pent-4-yne-1-sulfonamide |
| IUPAC Name | pent-4-yne-1-sulfonamide |
| InChI | InChI=1S/C5H9NO2S/c1-2-3-4-5-9(6,7)8/h1H,3-5H2,(H2,6,7,8) |
| InChI Key | KDSNTFJJJGFTHC-UHFFFAOYSA-N |
| MDL Number | MFCD26820502 |
| Molecular Formula | C5H9NO2S |
| Molecular Weight | 147.1955 |
| SMILES | NS(CCCC#C)(=O)=O |
| Synonyms | pent-4-yne-1-sulfonamide,
1565108-36-2,
AKOS026733938,
ZINC163512698,
Z2095765724,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.192g/mol |
| Monoisotopic Mass | 147.035g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 68.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number