(2-Methylpropyl)(2-phenylethyl)propanedioic acid
TL;DR: (2-Methylpropyl)(2-phenylethyl)propanedioic acid (CAS 7227-11-4) is a chemical compound with molecular formula C15H20O4 and molecular weight 264.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-methylpropyl)-2-(2-phenylethyl)propanedioic acid
Also Known As: (2-methylpropyl)(2-phenylethyl)propanedioic acid, KST-1A0299, 2-(2-methylpropyl)-2-phenethylpropanedioic acid
| Molecular Formula | C15H20O4 |
|---|---|
| Molecular Weight | 264.14 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.13617 |
| Heavy Atoms | 19 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 7227-11-4 |
|---|---|
| SMILES | CC(C)CC(CCC1=CC=CC=C1)(C(=O)O)C(=O)O |
| InChIKey | KSRCWCBLXGHIBB-UHFFFAOYSA-N |
Product Overview
(2-Methylpropyl)(2-phenylethyl)propanedioic acid (CAS 7227-11-4), with molecular formula C15H20O4 and molecular weight 264.14 g/mol. IUPAC: 2-(2-methylpropyl)-2-(2-phenylethyl)propanedioic acid.
Chemical Property Profile of (2-Methylpropyl)(2-phenylethyl)propanedioic acid
Property Insights of (2-Methylpropyl)(2-phenylethyl)propanedioic acid
The XLogP value of 3.3 indicates that (2-Methylpropyl)(2-phenylethyl)propanedioic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Methylpropyl)(2-phenylethyl)propanedioic acid. Following Lipinski's Rule of Five, (2-Methylpropyl)(2-phenylethyl)propanedioic acid has 2 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-Methylpropyl)(2-phenylethyl)propanedioic acid?
The CAS number of (2-Methylpropyl)(2-phenylethyl)propanedioic acid is 7227-11-4.
What is the molecular formula of (2-Methylpropyl)(2-phenylethyl)propanedioic acid?
The molecular formula of (2-Methylpropyl)(2-phenylethyl)propanedioic acid is C15H20O4.
What is the molecular weight of (2-Methylpropyl)(2-phenylethyl)propanedioic acid?
The molecular weight of (2-Methylpropyl)(2-phenylethyl)propanedioic acid is 264.14 g/mol.
Where can I buy (2-Methylpropyl)(2-phenylethyl)propanedioic acid?
You can request a quote for (2-Methylpropyl)(2-phenylethyl)propanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methylpropyl)(2-phenylethyl)propanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-Methylpropyl)(2-phenylethyl)propanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.