| CAS Number | 145878-34-8 |
| Catalog Number | AG00B7JC(AGN-PC-02JN83) |
| Chemical Name | N-(3-aminophenyl)aminosulfonamide |
| IUPAC Name | 1-amino-3-(sulfamoylamino)benzene |
| InChI | InChI=1S/C6H9N3O2S/c7-5-2-1-3-6(4-5)9-12(8,10)11/h1-4,9H,7H2,(H2,8,10,11) |
| InChI Key | FXCZOYHASUCPTG-UHFFFAOYSA-N |
| MDL Number | MFCD09935569 |
| Molecular Formula | C6H9N3O2S |
| Molecular Weight | 187.2196 |
| SMILES | NC1=CC(NS(N)(=O)=O)=CC=C1 |
| Synonyms | N-(3-aminophenyl)sulfamide,
145878-34-8,
N-(3-aminophenyl)aminosulfonamide,
Sulfamide, (3-aminophenyl)- (9CI),
AC1Q51QK,
SCHEMBL8547020,
CTK7D9167,
ZINC19471024,
AKOS000177573,
MCULE-9660943401,
NE46556,
NCGC00324725-01,
AJ-73587,
EN300-30447,
AB01319919-02,
Z367450864,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.217g/mol |
| Monoisotopic Mass | 187.042g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 107A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number