3,5-Dimethylpyrazolyl phenyl ketone
TL;DR: 3,5-Dimethylpyrazolyl phenyl ketone (CAS 1137-11-7) is a chemical compound with molecular formula C12H12N2O and molecular weight 200.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,5-dimethylpyrazol-1-yl)-phenylmethanone
Also Known As: 1-Benzoyl-3,5-dimethyl-1H-pyrazole, 3,5-dimethylpyrazolyl phenyl ketone, (3,5-dimethylpyrazol-1-yl)-phenylmethanone, (3,5-dimethylpyrazol-1-yl)-phenyl-methanone, J2.374.719G
Technical Specifications
| Molecular Formula | C12H12N2O |
| Molecular Weight | 200.09496 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 34.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 200.09496 Da |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
| SMILES | CC1=CC(=NN1C(=O)C2=CC=CC=C2)C |
| InChIKey | AHNLSPFBSUPXHJ-UHFFFAOYSA-N |
Chemical Property Profile of 3,5-Dimethylpyrazolyl phenyl ketone
Property Insights of 3,5-Dimethylpyrazolyl phenyl ketone
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Dimethylpyrazolyl phenyl ketone. With a topological polar surface area (TPSA) of 34.9 Ų, 3,5-Dimethylpyrazolyl phenyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dimethylpyrazolyl phenyl ketone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,5-Dimethylpyrazolyl phenyl ketone?
The CAS number of 3,5-Dimethylpyrazolyl phenyl ketone is 1137-11-7.
What is the molecular formula of 3,5-Dimethylpyrazolyl phenyl ketone?
The molecular formula of 3,5-Dimethylpyrazolyl phenyl ketone is C12H12N2O.
What is the molecular weight of 3,5-Dimethylpyrazolyl phenyl ketone?
The molecular weight of 3,5-Dimethylpyrazolyl phenyl ketone is 200.09496 g/mol.
Where can I buy 3,5-Dimethylpyrazolyl phenyl ketone?
You can request a quote for 3,5-Dimethylpyrazolyl phenyl ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,5-Dimethylpyrazolyl phenyl ketone?
Yes, CoreyChem provides custom synthesis services for 3,5-Dimethylpyrazolyl phenyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.