| CAS Number | 54135-43-2 |
| Catalog Number | AG01AGYF(AGN-PC-0OC0O4) |
| Chemical Name | N-(1H-pyrazol-3-yl)benzamide |
| IUPAC Name | N-(1H-pyrazol-5-yl)benzamide |
| InChI | InChI=1S/C10H9N3O/c14-10(8-4-2-1-3-5-8)12-9-6-7-11-13-9/h1-7H,(H2,11,12,13,14) |
| InChI Key | FQUKZFSJTRQNCO-UHFFFAOYSA-N |
| MDL Number | MFCD14657344 |
| Molecular Formula | C10H9N3O |
| Molecular Weight | 187.1980 |
| SMILES | C1=CC=C(C=C1)C(=O)NC2=CC=NN2 |
| Synonyms | N-(1H-pyrazol-3-yl)benzamide,
54135-43-2,
AC1Q5LRW,
SCHEMBL696662,
N-(1H-pyrazol-3-yl)-benzamide,
FQUKZFSJTRQNCO-UHFFFAOYSA-N,
ZINC38546668,
AKOS002390474,
AKOS006151216,
MCULE-3690334738,
NE41986,
EN300-73174,
Z827322128,
|
| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.075g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.202g/mol |
| Monoisotopic Mass | 187.075g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 57.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number