| CAS Number | 1018240-42-0 |
| Catalog Number | AG01B29S |
| Chemical Name | N-(2-methylpropyl)-2,3-dihydro-1H-indene-5-sulfonamide |
| IUPAC Name | N-(2-methylpropyl)-2,3-dihydro-1H-indene-5-sulfonamide |
| InChI | InChI=1S/C13H19NO2S/c1-10(2)9-14-17(15,16)13-7-6-11-4-3-5-12(11)8-13/h6-8,10,14H,3-5,9H2,1-2H3 |
| InChI Key | QFDOMJZOAYOZTK-UHFFFAOYSA-N |
| MDL Number | MFCD13520397 |
| Molecular Formula | C13H19NO2S |
| Molecular Weight | 253.3605 |
| SMILES | CC(CNS(C1=CC2=C(CCC2)C=C1)(=O)=O)C |
| Synonyms | N-(2-methylpropyl)-2,3-dihydro-1H-indene-5-sulfonamide,
1018240-42-0,
AC1P8EDD,
ZINC7375544,
AKOS008009685,
MCULE-6804391176,
AB01003686-01,
ZINC07375544,
CID8469397,
|
| Complexity | 345 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.114g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.36g/mol |
| Monoisotopic Mass | 253.114g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 54.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number