2-Methoxy-4-propoxybenzoic acid
TL;DR: 2-Methoxy-4-propoxybenzoic acid (CAS 104217-01-8) is a chemical compound with molecular formula C11H14O4 and molecular weight 210.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methoxy-4-propoxybenzoic acid
Also Known As: 2-methoxy-4-propoxybenzoic acid, 2-methoxy-4-propoxybenzoicacid, 2-methoxy-4-propoxy-benzoic acid, Benzoic acid, 2-methoxy-4-propoxy-
Technical Specifications
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.0892 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 210.0892 Da |
| Heavy Atoms | 15 |
| Complexity | 205.0 |
| SMILES | CCCOC1=CC(=C(C=C1)C(=O)O)OC |
| InChIKey | BYPSTFUCGUMFDO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methoxy-4-propoxybenzoic acid
Property Insights of 2-Methoxy-4-propoxybenzoic acid
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-4-propoxybenzoic acid. With a topological polar surface area (TPSA) of 55.8 Ų, 2-Methoxy-4-propoxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-4-propoxybenzoic 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 2-Methoxy-4-propoxybenzoic acid?
The CAS number of 2-Methoxy-4-propoxybenzoic acid is 104217-01-8.
What is the molecular formula of 2-Methoxy-4-propoxybenzoic acid?
The molecular formula of 2-Methoxy-4-propoxybenzoic acid is C11H14O4.
What is the molecular weight of 2-Methoxy-4-propoxybenzoic acid?
The molecular weight of 2-Methoxy-4-propoxybenzoic acid is 210.0892 g/mol.
Where can I buy 2-Methoxy-4-propoxybenzoic acid?
You can request a quote for 2-Methoxy-4-propoxybenzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methoxy-4-propoxybenzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Methoxy-4-propoxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.