![1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone structure](/static/products/7178/717872-00-9.webp)
1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone
TL;DR: 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone (CAS 717872-00-9) is a chemical compound with molecular formula C12H12F3NO and molecular weight 243.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
pyrrolidin-1-yl-[3-(trifluoromethyl)phenyl]methanone
Also Known As: SDCCGMLS-0039027.P002, 1-[3-(trifluoromethyl)benzoyl]pyrrolidine, pyrrolidinyl 3-(trifluoromethyl)phenyl ketone, 1-PYRROLIDINYL[3-(TRIFLUOROMETHYL)PHENYL]METHANONE, pyrrolidin-1-yl[3-(trifluoromethyl)phenyl]methanone
| Molecular Formula | C12H12F3NO |
|---|---|
| Molecular Weight | 243.09 g/mol |
| LogP | 2.9414 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 243.0871 |
| Heavy Atoms | 17 |
| Complexity | 422.00406 |
Chemical Identifiers
| CAS Number | 717872-00-9 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC(=CC=C2)C(F)(F)F |
Product Overview
1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone (CAS 717872-00-9), with molecular formula C12H12F3NO and molecular weight 243.09 g/mol. IUPAC: pyrrolidin-1-yl-[3-(trifluoromethyl)phenyl]methanone.
Chemical Property Profile of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone
Property Insights of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone
The XLogP value of 2.9414 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone. With a topological polar surface area (TPSA) of 20.31 Ų, 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone?
The CAS number of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone is 717872-00-9.
What is the molecular formula of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone?
The molecular formula of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone is C12H12F3NO.
What is the molecular weight of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone?
The molecular weight of 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone is 243.09 g/mol.
Where can I buy 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone?
You can request a quote for 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinyl[3-(trifluoromethyl)phenyl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.