| CAS Number | 937698-67-4 |
| Catalog Number | AG019W5X(AGN-PC-0WO32I) |
| Chemical Name | N-(3-aminopropyl)-N-ethylmethanesulfonamide |
| IUPAC Name | N-(3-aminopropyl)-N-ethylmethanesulfonamide |
| InChI | InChI=1S/C6H16N2O2S/c1-3-8(6-4-5-7)11(2,9)10/h3-7H2,1-2H3 |
| InChI Key | WUAVCOQSSHQHSJ-UHFFFAOYSA-N |
| MDL Number | MFCD09037312 |
| Molecular Formula | C6H16N2O2S |
| Molecular Weight | 180.2684 |
| SMILES | CCN(S(C)(=O)=O)CCCN |
| Synonyms | N-(3-aminopropyl)-N-ethylmethanesulfonamide,
937698-67-4,
AC1Q2ZLZ,
CTK7E8197,
ZINC36379669,
AKOS004118343,
MCULE-8575686079,
NE14092,
EN300-50634,
Z234894855,
|
| Complexity | 183 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 180.093g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 180.266g/mol |
| Monoisotopic Mass | 180.093g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number