2-(4-Fluorophenyl)propanedial
TL;DR: 2-(4-Fluorophenyl)propanedial (CAS 493045-87-7) is a chemical compound with molecular formula C9H7FO2 and molecular weight 166.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-fluorophenyl)propanedial
Also Known As: 2-(4-fluorophenyl)propanedial, 2-(4-fluorophenyl)malonaldehyde, 2-(4-Fluorophenyl)malondialdehyde, 2- MALONDIALDEHYDE, (4-Fluorophenyl)propanedial
| Molecular Formula | C9H7FO2 |
|---|---|
| Molecular Weight | 166.04 g/mol |
| LogP | 1.3071 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.04301 |
| Heavy Atoms | 12 |
| Complexity | 271.08493 |
Chemical Identifiers
| CAS Number | 493045-87-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C=O)C=O)F |
Product Overview
2-(4-Fluorophenyl)propanedial (CAS 493045-87-7), with molecular formula C9H7FO2 and molecular weight 166.04 g/mol. IUPAC: 2-(4-fluorophenyl)propanedial.
Chemical Property Profile of 2-(4-Fluorophenyl)propanedial
Property Insights of 2-(4-Fluorophenyl)propanedial
The XLogP value of 1.3071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Fluorophenyl)propanedial. With a topological polar surface area (TPSA) of 34.14 Ų, 2-(4-Fluorophenyl)propanedial exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Fluorophenyl)propanedial 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
Frequently Asked Questions
What is the CAS number of 2-(4-Fluorophenyl)propanedial?
The CAS number of 2-(4-Fluorophenyl)propanedial is 493045-87-7.
What is the molecular formula of 2-(4-Fluorophenyl)propanedial?
The molecular formula of 2-(4-Fluorophenyl)propanedial is C9H7FO2.
What is the molecular weight of 2-(4-Fluorophenyl)propanedial?
The molecular weight of 2-(4-Fluorophenyl)propanedial is 166.04 g/mol.
Where can I buy 2-(4-Fluorophenyl)propanedial?
You can request a quote for 2-(4-Fluorophenyl)propanedial directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Fluorophenyl)propanedial?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Fluorophenyl)propanedial and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.