3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid
TL;DR: 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid (CAS 1374414-04-6) is a chemical compound with molecular formula C13H16O4 and molecular weight 236.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(3-methoxy-4-propoxyphenyl)prop-2-enoic acid
Also Known As: 3-(3-methoxy-4-propoxyphenyl)prop-2-enoic acid, 3-(3-Methoxy-4-propoxy-phenyl)-acrylic acid, 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid, 3-(3-methoxy-4-propoxy-phenyl)prop-2-enoic Acid, (2E)-3-(3-METHOXY-4-PROPOXYPHENYL)ACRYLIC ACID
Technical Specifications
| Molecular Formula | C13H16O4 |
| Molecular Weight | 236.10486 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 236.10486 Da |
| Heavy Atoms | 17 |
| Complexity | 262.0 |
| SMILES | CCCOC1=C(C=C(C=C1)C=CC(=O)O)OC |
| InChIKey | QLWJYHRZUFQUDK-UHFFFAOYSA-N |
Chemical Property Profile of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid
Property Insights of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid?
The CAS number of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid is 1374414-04-6.
What is the molecular formula of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid?
The molecular formula of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid is C13H16O4.
What is the molecular weight of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid?
The molecular weight of 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid is 236.10486 g/mol.
Where can I buy 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid?
You can request a quote for 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid?
Yes, CoreyChem provides custom synthesis services for 3-(3-Methoxy-4-propoxyphenyl)-2-propenoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.