| CAS Number | 1026764-45-3 |
| Catalog Number | AG01A0RS |
| Chemical Name | 3-(4-ethylphenyl)-1H-pyrazole-5-carbohydrazide |
| IUPAC Name | 3-(4-ethylphenyl)-1H-pyrazole-5-carbohydrazide |
| InChI | InChI=1S/C12H14N4O/c1-2-8-3-5-9(6-4-8)10-7-11(16-15-10)12(17)14-13/h3-7H,2,13H2,1H3,(H,14,17)(H,15,16) |
| InChI Key | MDNCZRQYPWNBEO-UHFFFAOYSA-N |
| MDL Number | MFCD02673707 |
| Molecular Formula | C12H14N4O |
| Molecular Weight | 230.2658 |
| SMILES | CCC1=CC=C(C2=NNC(C(NN)=O)=C2)C=C1 |
| Synonyms | 3-(4-ethylphenyl)-1H-pyrazole-5-carbohydrazide,
1026764-45-3,
3-(4-ethylphenyl)pyrazole-5-carbohydrazide,
AC1NDKHG,
ZINC408746,
SBB040988,
AKOS000269667,
MCULE-7361605566,
NE12125,
ST50214633,
EN300-110841,
5-(4-ethylphenyl)-2H-pyrazole-3-carboxylic acid hydrazide,
CID4577338,
5-(4-ethylphenyl)-2H-pyrazole-3-carbohydrazide,
|
| Complexity | 263 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.117g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.271g/mol |
| Monoisotopic Mass | 230.117g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 83.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number