2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid
TL;DR: 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid (CAS 42288-64-2) is a chemical compound with molecular formula C13H18O2 and molecular weight 206.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2,2-dimethylpropyl)phenyl]acetic acid
Also Known As: (4-neopentylphenyl)acetic acid, 2-[4-(2,2-dimethylpropyl)phenyl]acetic acid, AE-562/43287081, 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid, 990-182-6
| Molecular Formula | C13H18O2 |
|---|---|
| Molecular Weight | 206.13 g/mol |
| LogP | 2.9023 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 206.13068 |
| Heavy Atoms | 15 |
| Complexity | 330.54874 |
Chemical Identifiers
| CAS Number | 42288-64-2 |
|---|---|
| SMILES | CC(C)(C)CC1=CC=C(C=C1)CC(=O)O |
Product Overview
2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid (CAS 42288-64-2), with molecular formula C13H18O2 and molecular weight 206.13 g/mol. IUPAC: 2-[4-(2,2-dimethylpropyl)phenyl]acetic acid.
Chemical Property Profile of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid
Property Insights of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid
The XLogP value of 2.9023 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid has 1 hydrogen bond donor(s) and 1 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-(2,2-Dimethylpropyl)phenyl)acetic acid?
The CAS number of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid is 42288-64-2.
What is the molecular formula of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid?
The molecular formula of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid is C13H18O2.
What is the molecular weight of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid?
The molecular weight of 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid is 206.13 g/mol.
Where can I buy 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid?
You can request a quote for 2-(4-(2,2-Dimethylpropyl)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-(2,2-Dimethylpropyl)phenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(2,2-Dimethylpropyl)phenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.