4-Benzyloxy-3-methoxyphenylacetic Acid
TL;DR: 4-Benzyloxy-3-methoxyphenylacetic Acid (CAS 29973-91-9) is a chemical compound with molecular formula C16H16O4 and molecular weight 272.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid
Also Known As: 4-Benzyloxy-3-methoxyphenylacetic acid, 4-Methoxybenzophenone, Maybridge3_000484, 2-(4-(benzyloxy)-3-methoxyphenyl)acetic acid, 2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid
| Molecular Formula | C16H16O4 |
|---|---|
| Molecular Weight | 272.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.10486 |
| Heavy Atoms | 20 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 29973-91-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CC(=O)O)OCC2=CC=CC=C2 |
| InChIKey | AYCIHUSEBJLTBF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Benzyloxy-3-methoxyphenylacetic Acid (CAS 29973-91-9), with molecular formula C16H16O4 and molecular weight 272.10 g/mol. IUPAC: 2-(3-methoxy-4-phenylmethoxyphenyl)acetic acid.
Chemical Property Profile of 4-Benzyloxy-3-methoxyphenylacetic Acid
Property Insights of 4-Benzyloxy-3-methoxyphenylacetic Acid
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzyloxy-3-methoxyphenylacetic Acid. With a topological polar surface area (TPSA) of 55.8 Ų, 4-Benzyloxy-3-methoxyphenylacetic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzyloxy-3-methoxyphenylacetic 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
Frequently Asked Questions
What is the CAS number of 4-Benzyloxy-3-methoxyphenylacetic Acid?
The CAS number of 4-Benzyloxy-3-methoxyphenylacetic Acid is 29973-91-9.
What is the molecular formula of 4-Benzyloxy-3-methoxyphenylacetic Acid?
The molecular formula of 4-Benzyloxy-3-methoxyphenylacetic Acid is C16H16O4.
What is the molecular weight of 4-Benzyloxy-3-methoxyphenylacetic Acid?
The molecular weight of 4-Benzyloxy-3-methoxyphenylacetic Acid is 272.10 g/mol.
Where can I buy 4-Benzyloxy-3-methoxyphenylacetic Acid?
You can request a quote for 4-Benzyloxy-3-methoxyphenylacetic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzyloxy-3-methoxyphenylacetic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzyloxy-3-methoxyphenylacetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.