| CAS Number | 953885-64-8 |
| Catalog Number | AG019MRZ |
| Chemical Name | 3-(Methylsulfonyl)benzohydrazide |
| IUPAC Name | 3-methylsulfonylbenzohydrazide |
| InChI | InChI=1S/C8H10N2O3S/c1-14(12,13)7-4-2-3-6(5-7)8(11)10-9/h2-5H,9H2,1H3,(H,10,11) |
| InChI Key | QPQVGKOKFZZZMQ-UHFFFAOYSA-N |
| MDL Number | MFCD09729230 |
| Molecular Formula | C8H10N2O3S |
| Molecular Weight | 214.2416 |
| SMILES | CS(C1=CC(C(NN)=O)=CC=C1)(=O)=O |
| Synonyms | 3-methanesulfonylbenzohydrazide,
3-(methylsulfonyl)benzohydrazide,
EN300-37097,
953885-64-8,
AC1Q4GGW,
3-(methysulfonyl)benzohydrazide,
SCHEMBL14482756,
CTK7F0512,
QPQVGKOKFZZZMQ-UHFFFAOYSA-N,
ZINC22166720,
AKOS000138183,
BBV-021094,
FCH5616683,
NE29242,
|
| Complexity | 307 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 214.041g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 214.239g/mol |
| Monoisotopic Mass | 214.041g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 97.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number