2-Benzyl-2-(4-chlorophenyl)hexanoic acid
TL;DR: 2-Benzyl-2-(4-chlorophenyl)hexanoic acid (CAS 34927-64-5) is a chemical compound with molecular formula C19H21ClO2 and molecular weight 316.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-2-(4-chlorophenyl)hexanoic acid
Also Known As: 2-benzyl-2-(4-chlorophenyl)hexanoic acid
| Molecular Formula | C19H21ClO2 |
|---|---|
| Molecular Weight | 316.12 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 316.12302 |
| Heavy Atoms | 22 |
| Complexity | 343.0 |
Chemical Identifiers
| CAS Number | 34927-64-5 |
|---|---|
| SMILES | CCCCC(CC1=CC=CC=C1)(C2=CC=C(C=C2)Cl)C(=O)O |
| InChIKey | DXUBWNXUFPOUSV-UHFFFAOYSA-N |
Product Overview
2-Benzyl-2-(4-chlorophenyl)hexanoic acid (CAS 34927-64-5), with molecular formula C19H21ClO2 and molecular weight 316.12 g/mol. IUPAC: 2-benzyl-2-(4-chlorophenyl)hexanoic acid.
Chemical Property Profile of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid
Property Insights of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid
The XLogP value of 5.8 indicates that 2-Benzyl-2-(4-chlorophenyl)hexanoic 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-Benzyl-2-(4-chlorophenyl)hexanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-2-(4-chlorophenyl)hexanoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid?
The CAS number of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid is 34927-64-5.
What is the molecular formula of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid?
The molecular formula of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid is C19H21ClO2.
What is the molecular weight of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid?
The molecular weight of 2-Benzyl-2-(4-chlorophenyl)hexanoic acid is 316.12 g/mol.
Where can I buy 2-Benzyl-2-(4-chlorophenyl)hexanoic acid?
You can request a quote for 2-Benzyl-2-(4-chlorophenyl)hexanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzyl-2-(4-chlorophenyl)hexanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-2-(4-chlorophenyl)hexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.