| CAS Number | 350997-59-0 |
| Catalog Number | AG00JBV9(AGN-PC-0WBYD9) |
| Chemical Name | 3-ISOBUTOXYBENZOHYDRAZIDE |
| IUPAC Name | 3-(2-methylpropoxy)benzohydrazide |
| InChI | InChI=1S/C11H16N2O2/c1-8(2)7-15-10-5-3-4-9(6-10)11(14)13-12/h3-6,8H,7,12H2,1-2H3,(H,13,14) |
| InChI Key | QBMFDOXZJFUFHR-UHFFFAOYSA-N |
| MDL Number | MFCD01993663 |
| Molecular Formula | C11H16N2O2 |
| Molecular Weight | 208.2569 |
| SMILES | C(NN)(=O)C1=CC=CC(OCC(C)C)=C1 |
| Synonyms | 3-isobutoxybenzohydrazide,
3-(2-methylpropoxy)benzohydrazide,
350997-59-0,
3-Isobutoxy-benzoic acid hydrazide,
AC1MC0A1,
Oprea1_809733,
3-isobutoxybenzoic acid hydrazide,
CTK7F0501,
ALBB-002474,
ZINC2576191,
BBL016748,
MFCD01993663,
STK433297,
AKOS003270425,
MCULE-7873007732,
3-(2-methylpropoxy)benzenecarbohydrazide,
TR-052577,
R5279,
ST50944962,
ZINC02576191,
CID2759382,
|
| Complexity | 207 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.261g/mol |
| Monoisotopic Mass | 208.121g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number