Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-
TL;DR: Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- (CAS 900704-20-3) is a chemical compound with molecular formula C15H22O4 and molecular weight 266.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-ethoxy-4-pentoxyphenyl)acetic acid
Also Known As: Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-, 2-(3-ethoxy-4-pentoxyphenyl)acetic acid, 3-Ethoxy-4-(pentyloxy)benzeneacetic acid, 2-(3-ethoxy-4-pentoxy-phenyl)acetic Acid, [3-Ethoxy-4-(pentyloxy)phenyl]acetic acid
| Molecular Formula | C15H22O4 |
|---|---|
| Molecular Weight | 266.15 g/mol |
| LogP | 3.2814 |
| Topological Polar Surface Area | 55.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 266.1518 |
| Heavy Atoms | 19 |
| Complexity | 401.13208 |
Chemical Identifiers
| CAS Number | 900704-20-3 |
|---|---|
| SMILES | CCCCCOC1=C(C=C(C=C1)CC(=O)O)OCC |
Product Overview
Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- (CAS 900704-20-3), with molecular formula C15H22O4 and molecular weight 266.15 g/mol. IUPAC: 2-(3-ethoxy-4-pentoxyphenyl)acetic acid.
Chemical Property Profile of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-
Property Insights of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-
The XLogP value of 3.2814 indicates that Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.76 Ų, Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- has 1 hydrogen bond donor(s) and 3 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 Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-?
The CAS number of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- is 900704-20-3.
What is the molecular formula of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-?
The molecular formula of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- is C15H22O4.
What is the molecular weight of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-?
The molecular weight of Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- is 266.15 g/mol.
Where can I buy Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-?
You can request a quote for Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 3-ethoxy-4-(pentyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.