| CAS Number | 851879-15-7 |
| Catalog Number | AG00IDKJ |
| Chemical Name | 4-[1-(METHYLAMINO)ETHYL]BENZENE-1-SULFONAMIDE |
| IUPAC Name | 4-[1-(methylamino)ethyl]benzenesulfonamide |
| InChI | InChI=1S/C9H14N2O2S/c1-7(11-2)8-3-5-9(6-4-8)14(10,12)13/h3-7,11H,1-2H3,(H2,10,12,13) |
| InChI Key | DYXBDKAGCQTXGF-UHFFFAOYSA-N |
| MDL Number | MFCD06655269 |
| Molecular Formula | C9H14N2O2S |
| Molecular Weight | 214.2847 |
| SMILES | CNC(C)C1=CC=C(C=C1)S(=O)(=O)N |
| Synonyms | 4-[1-(methylamino)ethyl]benzenesulfonamide,
4-[1-(methylamino)ethyl]benzene-1-sulfonamide,
851879-15-7,
AC1NLPPL,
AC1Q40SL,
MLS000775528,
SCHEMBL8285878,
CHEMBL1418799,
CTK6I4611,
HMS2647D03,
MFCD06655269,
AKOS000118472,
AKOS016885152,
MCULE-9813872920,
NE40261,
SMR000370413,
EN300-12278,
4-[1-(methylamino)ethyl]benzenesulfonamide, AldrichCPR,
CID4961836,
4-(1-methylaminoethyl)benzenesulfonamide,
|
| Complexity | 263 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.078g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.283g/mol |
| Monoisotopic Mass | 214.078g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number