| CAS Number | 72411-51-9 |
| Catalog Number | AG00FF86(AGN-PC-0WBOFW) |
| Chemical Name | 1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-amine |
| IUPAC Name | 2-(4-fluorophenyl)-5-phenylpyrazol-3-amine |
| InChI | InChI=1S/C15H12FN3/c16-12-6-8-13(9-7-12)19-15(17)10-14(18-19)11-4-2-1-3-5-11/h1-10H,17H2 |
| InChI Key | PPEUUMAZFYWELH-UHFFFAOYSA-N |
| MDL Number | MFCD04122794 |
| Molecular Formula | C15H12FN3 |
| Molecular Weight | 253.2743 |
| SMILES | NC1N(C2=CC=C(F)C=C2)N=C(C2=CC=CC=C2)C=1 |
| Synonyms | 1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-amine,
72411-51-9,
1-(4-Fluorophenyl)-3-phenyl-1H-pyrazol-5-ylamine,
AC1N9TSU,
AC1Q51IM,
CTK7C0801,
DTXSID30402775,
ZINC2532565,
4560AH,
MFCD04122794,
AKOS009113549,
MCULE-7778398812,
2-(4-fluorophenyl)-5-phenylpyrazol-3-amine,
EN300-86697,
A-8832,
C15H12FN3,
CID4391150,
2-(4-fluorophenyl)-5-phenyl-pyrazol-3-amine,
|
| Complexity | 285 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 253.102g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 253.28g/mol |
| Monoisotopic Mass | 253.102g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number