![3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid structure](/static/products/6951/695186-85-7.webp)
3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid
TL;DR: 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid (CAS 695186-85-7) is a chemical compound with molecular formula C12H13FO3 and molecular weight 224.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(3-fluoropropoxy)phenyl]prop-2-enoic acid
Also Known As: 3-[4-(3-Fluoropropoxy)phenyl]acrylic acid, 3-[4-(3-fluoropropoxy)phenyl]prop-2-enoic Acid, 3-[4-(3-fluoropropoxy)phenyl]-2-propenoic acid, (E)-3-[4-(3-fluoropropoxy)phenyl]prop-2-enoic acid, (2E)-3-[4-(3-fluoropropoxy)phenyl]prop-2-enoic acid
| Molecular Formula | C12H13FO3 |
|---|---|
| Molecular Weight | 224.08 g/mol |
| LogP | 2.5228 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 224.08487 |
| Heavy Atoms | 16 |
| Complexity | 357.03156 |
Chemical Identifiers
| CAS Number | 695186-85-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C=CC(=O)O)OCCCF |
Product Overview
3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid (CAS 695186-85-7), with molecular formula C12H13FO3 and molecular weight 224.08 g/mol. IUPAC: 3-[4-(3-fluoropropoxy)phenyl]prop-2-enoic acid.
Chemical Property Profile of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid
Property Insights of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid
The XLogP value of 2.5228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid. With a topological polar surface area (TPSA) of 46.53 Ų, 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid has 1 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 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid?
The CAS number of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid is 695186-85-7.
What is the molecular formula of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid?
The molecular formula of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid is C12H13FO3.
What is the molecular weight of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid?
The molecular weight of 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid is 224.08 g/mol.
Where can I buy 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid?
You can request a quote for 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(3-Fluoropropoxy)phenyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.