3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid
TL;DR: 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid (CAS 416879-41-9) is a chemical compound with molecular formula C14H20O2 and molecular weight 220.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-3-(4-propan-2-ylphenyl)butanoic acid
Also Known As: 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid, 3-methyl-3-[4-(propan-2-yl)phenyl]butanoic acid, 3-(4-ISOPROPYLPHENYL)-3-METHYLBUTANOIC ACID, AB00086388-01
| Molecular Formula | C14H20O2 |
|---|---|
| Molecular Weight | 220.15 g/mol |
| LogP | 3.5623 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.14633 |
| Heavy Atoms | 16 |
| Complexity | 360.82666 |
Chemical Identifiers
| CAS Number | 416879-41-9 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C(C)(C)CC(=O)O |
Product Overview
3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid (CAS 416879-41-9), with molecular formula C14H20O2 and molecular weight 220.15 g/mol. IUPAC: 3-methyl-3-(4-propan-2-ylphenyl)butanoic acid.
Chemical Property Profile of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid
Property Insights of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid
The XLogP value of 3.5623 indicates that 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-methyl-3-(4-propan-2-ylphenyl)butanoic 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 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid?
The CAS number of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid is 416879-41-9.
What is the molecular formula of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid?
The molecular formula of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid is C14H20O2.
What is the molecular weight of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid?
The molecular weight of 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid is 220.15 g/mol.
Where can I buy 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid?
You can request a quote for 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-3-(4-propan-2-ylphenyl)butanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.