| CAS Number | 735322-66-4 |
| Catalog Number | AG00ICES |
| Chemical Name | 4-(pyrrolidine-1-sulfonyl)benzohydrazide |
| IUPAC Name | 4-pyrrolidin-1-ylsulfonylbenzohydrazide |
| InChI | InChI=1S/C11H15N3O3S/c12-13-11(15)9-3-5-10(6-4-9)18(16,17)14-7-1-2-8-14/h3-6H,1-2,7-8,12H2,(H,13,15) |
| InChI Key | OJOMJVZSAFQXRT-UHFFFAOYSA-N |
| MDL Number | MFCD04614717 |
| Molecular Formula | C11H15N3O3S |
| Molecular Weight | 269.3201 |
| SMILES | NNC(C1=CC=C(S(N2CCCC2)(=O)=O)C=C1)=O |
| Synonyms | 4-(pyrrolidine-1-sulfonyl)benzohydrazide,
4-(pyrrolidin-1-ylsulfonyl)benzohydrazide,
735322-66-4,
AC1MWJW9,
AC1Q54T0,
SCHEMBL16197618,
CTK7F0352,
ZINC3887264,
MFCD04614717,
AKOS008967113,
4-pyrrolidin-1-ylsulfonylbenzohydrazide,
MCULE-9041576392,
NE12900,
EN300-08342,
SR-01000045632,
SR-01000045632-1,
Z56933822,
ZINC03887264,
CID3800433,
|
| Complexity | 390 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.083g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.319g/mol |
| Monoisotopic Mass | 269.083g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 101A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number