| CAS Number | 1152711-96-0 |
| Catalog Number | AG01DTNW |
| Chemical Name | 3-cyclohexyl-1-phenyl-1H-pyrazol-5-amine |
| IUPAC Name | 5-cyclohexyl-2-phenylpyrazol-3-amine |
| InChI | InChI=1S/C15H19N3/c16-15-11-14(12-7-3-1-4-8-12)17-18(15)13-9-5-2-6-10-13/h2,5-6,9-12H,1,3-4,7-8,16H2 |
| InChI Key | QYGBFVMPZTXNSQ-UHFFFAOYSA-N |
| MDL Number | MFCD11209745 |
| Molecular Formula | C15H19N3 |
| Molecular Weight | 241.3315 |
| SMILES | Nc1cc(nn1c1ccccc1)C1CCCCC1 |
| Synonyms | 3-Cyclohexyl-1-phenyl-1H-pyrazol-5-amine,
1152711-96-0,
|
| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 241.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 241.338g/mol |
| Monoisotopic Mass | 241.158g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
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Certificate of Analysis
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