| CAS Number | 100800-56-4 |
| Catalog Number | AG00949C(AGN-PC-0WRABF) |
| Chemical Name | 3-amino-N-cyclohexyl-4-methylbenzenesulfonamide |
| IUPAC Name | 3-amino-N-cyclohexyl-4-methylbenzenesulfonamide |
| InChI | InChI=1S/C13H20N2O2S/c1-10-7-8-12(9-13(10)14)18(16,17)15-11-5-3-2-4-6-11/h7-9,11,15H,2-6,14H2,1H3 |
| InChI Key | CQHDYYBKMPCSKE-UHFFFAOYSA-N |
| MDL Number | MFCD11121884 |
| Molecular Formula | C13H20N2O2S |
| Molecular Weight | 268.3751 |
| SMILES | Cc1ccc(cc1N)S(=O)(=O)NC1CCCCC1 |
| Synonyms | 3-amino-N-cyclohexyl-4-methylbenzenesulfonamide,
100800-56-4,
ZINC20130631,
CJ-16546,
Z6315,
C13H20N2O2S,
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| Complexity | 358 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.125g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.375g/mol |
| Monoisotopic Mass | 268.125g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 80.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number