3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid
TL;DR: 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid (CAS 913699-82-8) is a chemical compound with molecular formula C10H9FO2 and molecular weight 180.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-fluoro-3-methylphenyl)prop-2-enoic acid
Also Known As: 4-Fluoro-3-methylcinnamic acid, 3-(4-fluoro-3-methylphenyl)prop-2-enoic acid, 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid, (2E)-3-(4-fluoro-3-methylphenyl)prop-2-enoic acid
| Molecular Formula | C10H9FO2 |
|---|---|
| Molecular Weight | 180.06 g/mol |
| LogP | 2.23192 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.05865 |
| Heavy Atoms | 13 |
| Complexity | 355.9424 |
Chemical Identifiers
| CAS Number | 913699-82-8 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C=CC(=O)O)F |
Product Overview
3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid (CAS 913699-82-8), with molecular formula C10H9FO2 and molecular weight 180.06 g/mol. IUPAC: 3-(4-fluoro-3-methylphenyl)prop-2-enoic acid.
Chemical Property Profile of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid
Property Insights of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid
The XLogP value of 2.23192 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid has 1 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 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid?
The CAS number of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid is 913699-82-8.
What is the molecular formula of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid?
The molecular formula of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid is C10H9FO2.
What is the molecular weight of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid?
The molecular weight of 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid is 180.06 g/mol.
Where can I buy 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid?
You can request a quote for 3-(4-fluoro-3-methyl-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-fluoro-3-methyl-phenyl)prop-2-enoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-fluoro-3-methyl-phenyl)prop-2-enoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.