2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid
TL;DR: 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid (CAS 3552-16-7) is a chemical compound with molecular formula C12H24O2 and molecular weight 200.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,2-dimethylpropyl)-4,4-dimethylpentanoic acid
Also Known As: 2-(2,2-dimethylpropyl)-4,4-dimethylpentanoic acid, 4,4-dimethyl-2-neopentyl-valeric acid, 4,4-Dimethyl-2-neopentyl-valeriansaeure, Pentanoic acid,2-(2,2-dimethylpropyl)-4,4-dimethyl-
| Molecular Formula | C12H24O2 |
|---|---|
| Molecular Weight | 200.18 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 200.17763 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 3552-16-7 |
|---|---|
| SMILES | CC(C)(C)CC(CC(C)(C)C)C(=O)O |
| InChIKey | PQKYLIYFBFVIOW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid (CAS 3552-16-7), with molecular formula C12H24O2 and molecular weight 200.18 g/mol. IUPAC: 2-(2,2-dimethylpropyl)-4,4-dimethylpentanoic acid.
Chemical Property Profile of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid
Property Insights of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid
The XLogP value of 3.9 indicates that 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic 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, 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid has 1 hydrogen bond donor(s) and 2 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-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid?
The CAS number of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid is 3552-16-7.
What is the molecular formula of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid?
The molecular formula of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid is C12H24O2.
What is the molecular weight of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid?
The molecular weight of 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid is 200.18 g/mol.
Where can I buy 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid?
You can request a quote for 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(2,2-Dimethylpropyl)-4,4-dimethylpentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.