2-(4-(Acetyloxy)phenyl)acetic acid
TL;DR: 2-(4-(Acetyloxy)phenyl)acetic acid (CAS 469880-62-4) is a chemical compound with molecular formula C10H10O4 and molecular weight 194.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-acetyloxyphenyl)acetic acid
Also Known As: 2-[4-(acetyloxy)phenyl]acetic acid, [4-(acetyloxy)phenyl]acetic acid, p-acetoxyphenylacetic acid, 2-(4-acetyloxyphenyl)acetic acid, 4-acetoxyphenylacetic acid
| Molecular Formula | C10H10O4 |
|---|---|
| Molecular Weight | 194.06 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.0579 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 469880-62-4 |
|---|---|
| SMILES | CC(=O)OC1=CC=C(C=C1)CC(=O)O |
| InChIKey | WCTJRKVPYCQVQM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-(Acetyloxy)phenyl)acetic acid (CAS 469880-62-4), with molecular formula C10H10O4 and molecular weight 194.06 g/mol. IUPAC: 2-(4-acetyloxyphenyl)acetic acid.
Chemical Property Profile of 2-(4-(Acetyloxy)phenyl)acetic acid
Property Insights of 2-(4-(Acetyloxy)phenyl)acetic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-(Acetyloxy)phenyl)acetic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(Acetyloxy)phenyl)acetic acid. Following Lipinski's Rule of Five, 2-(4-(Acetyloxy)phenyl)acetic 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 2-(4-(Acetyloxy)phenyl)acetic acid?
The CAS number of 2-(4-(Acetyloxy)phenyl)acetic acid is 469880-62-4.
What is the molecular formula of 2-(4-(Acetyloxy)phenyl)acetic acid?
The molecular formula of 2-(4-(Acetyloxy)phenyl)acetic acid is C10H10O4.
What is the molecular weight of 2-(4-(Acetyloxy)phenyl)acetic acid?
The molecular weight of 2-(4-(Acetyloxy)phenyl)acetic acid is 194.06 g/mol.
Where can I buy 2-(4-(Acetyloxy)phenyl)acetic acid?
You can request a quote for 2-(4-(Acetyloxy)phenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(Acetyloxy)phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(Acetyloxy)phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.