![1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde structure](/static/products/2991/299168-08-4.webp)
1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde
TL;DR: 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde (CAS 299168-08-4) is a chemical compound with molecular formula C13H7F6NO and molecular weight 307.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[3,5-bis(trifluoromethyl)phenyl]pyrrole-2-carbaldehyde
Also Known As: 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde, 1-[3,5-bis(trifluoromethyl)phenyl]pyrrole-2-carbaldehyde
| Molecular Formula | C13H7F6NO |
|---|---|
| Molecular Weight | 307.04 g/mol |
| LogP | 4.3274 |
| Topological Polar Surface Area | 22.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 307.04318 |
| Heavy Atoms | 21 |
| Complexity | 635.7815 |
Chemical Identifiers
| CAS Number | 299168-08-4 |
|---|---|
| SMILES | C1=CN(C(=C1)C=O)C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F |
Product Overview
1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde (CAS 299168-08-4), with molecular formula C13H7F6NO and molecular weight 307.04 g/mol. IUPAC: 1-[3,5-bis(trifluoromethyl)phenyl]pyrrole-2-carbaldehyde.
Chemical Property Profile of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde
Property Insights of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde
The XLogP value of 4.3274 indicates that 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.0 Ų, 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde 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-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde?
The CAS number of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde is 299168-08-4.
What is the molecular formula of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde?
The molecular formula of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde is C13H7F6NO.
What is the molecular weight of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde?
The molecular weight of 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde is 307.04 g/mol.
Where can I buy 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde?
You can request a quote for 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 1-[3,5-bis(trifluoromethyl)phenyl]-1H-pyrrole-2-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.