| CAS Number | 413573-34-9 |
| Catalog Number | AG01B17X |
| Chemical Name | N-cyclopentyl-4-nitrobenzene-1-sulfonamide |
| IUPAC Name | N-cyclopentyl-4-nitrobenzenesulfonamide |
| InChI | InChI=1S/C11H14N2O4S/c14-13(15)10-5-7-11(8-6-10)18(16,17)12-9-3-1-2-4-9/h5-9,12H,1-4H2 |
| InChI Key | AHIDFHGCZZOGJB-UHFFFAOYSA-N |
| MDL Number | MFCD00451512 |
| Molecular Formula | C11H14N2O4S |
| Molecular Weight | 270.3049 |
| SMILES | [O-][N+](C1=CC=C(S(NC2CCCC2)(=O)=O)C=C1)=O |
| Synonyms | N-cyclopentyl-4-nitrobenzene-1-sulfonamide,
N-cyclopentyl-4-nitrobenzenesulfonamide,
413573-34-9,
AC1LQR1I,
Cambridge id 5181879,
Oprea1_153652,
SCHEMBL20271516,
ZINC1233452,
MFCD00451512,
STK028701,
AKOS001111412,
MCULE-5887791790,
NE52356,
cyclopentyl[(4-nitrophenyl)sulfonyl]amine,
ST50688732,
Z45537366,
ZINC01233452,
CID1380962,
|
| Complexity | 384 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 270.067g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 270.303g/mol |
| Monoisotopic Mass | 270.067g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 100A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number