| CAS Number | 1393532-43-8 |
| Catalog Number | AG00IL2M(AGN-PC-0WQUQU) |
| Chemical Name | 1-Cyclopropyl-1H-pyrazole-5-carboxylic acid |
| IUPAC Name | 2-cyclopropylpyrazole-3-carboxylic acid |
| InChI | InChI=1S/C7H8N2O2/c10-7(11)6-3-4-8-9(6)5-1-2-5/h3-5H,1-2H2,(H,10,11) |
| InChI Key | CUAWMPGXOJKBBM-UHFFFAOYSA-N |
| MDL Number | MFCD22547949 |
| Molecular Formula | C7H8N2O2 |
| Molecular Weight | 152.1506 |
| SMILES | OC(=O)C1=CC=NN1C1CC1 |
| Synonyms | 1-CYCLOPROPYL-1H-PYRAZOLE-5-CARBOXYLIC ACID,
1393532-43-8,
1H-Pyrazole-5-carboxylic acid, 1-cyclopropyl-,
SCHEMBL17437926,
CUAWMPGXOJKBBM-UHFFFAOYSA-N,
MFCD22547949,
ZINC75852172,
AKOS023100525,
AB84854,
2-cyclopropylpyrazole-3-carboxylic acid,
AS-43667,
SC-13095,
CS-0052577,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 152.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 152.153g/mol |
| Monoisotopic Mass | 152.059g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 55.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number