| CAS Number | 1000932-12-6 |
| Catalog Number | AG019L8V |
| Chemical Name | N-(3-Cyanophenyl)sulfamide |
| IUPAC Name | 1-cyano-3-(sulfamoylamino)benzene |
| InChI | InChI=1S/C7H7N3O2S/c8-5-6-2-1-3-7(4-6)10-13(9,11)12/h1-4,10H,(H2,9,11,12) |
| InChI Key | LUTLSZGLFSAVND-UHFFFAOYSA-N |
| MDL Number | MFCD09863348 |
| Molecular Formula | C7H7N3O2S |
| Molecular Weight | 197.2144 |
| SMILES | NS(NC1=CC(C#N)=CC=C1)(=O)=O |
| Synonyms | N-(3-cyanophenyl)sulfamide,
N-(3-cyanophenyl)aminosulfonamide,
EN300-30478,
1000932-12-6,
AC1Q55HE,
CTK7C8562,
ZINC13013672,
AKOS000201756,
FCH5234514,
MCULE-4602476409,
NE37889,
NCGC00338524-01,
AB01330903-02,
Z355423020,
|
| Complexity | 310 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 197.026g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 197.212g/mol |
| Monoisotopic Mass | 197.026g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 104A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number