2,6-Dichlorophenyl valerate
TL;DR: 2,6-Dichlorophenyl valerate (CAS 71463-59-7) is a chemical compound with molecular formula C11H12Cl2O2 and molecular weight 246.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dichlorophenyl) pentanoate
Also Known As: 2,6-Dichlorophenyl valerate, 2,6-dichlorophenylvalerate, (2,6-dichlorophenyl) pentanoate, EINECS 275-498-8, 2,6-DICHLOROPHENYL PENTANOATE
| Molecular Formula | C11H12Cl2O2 |
|---|---|
| Molecular Weight | 246.02 g/mol |
| LogP | 4.089 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 246.02144 |
| Heavy Atoms | 15 |
| Complexity | 330.1912 |
Chemical Identifiers
| CAS Number | 71463-59-7 |
|---|---|
| SMILES | CCCCC(=O)OC1=C(C=CC=C1Cl)Cl |
Product Overview
2,6-Dichlorophenyl valerate (CAS 71463-59-7), with molecular formula C11H12Cl2O2 and molecular weight 246.02 g/mol. IUPAC: (2,6-dichlorophenyl) pentanoate.
Chemical Property Profile of 2,6-Dichlorophenyl valerate
Property Insights of 2,6-Dichlorophenyl valerate
The XLogP value of 4.089 indicates that 2,6-Dichlorophenyl valerate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2,6-Dichlorophenyl valerate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dichlorophenyl valerate has 0 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 2,6-Dichlorophenyl valerate?
The CAS number of 2,6-Dichlorophenyl valerate is 71463-59-7.
What is the molecular formula of 2,6-Dichlorophenyl valerate?
The molecular formula of 2,6-Dichlorophenyl valerate is C11H12Cl2O2.
What is the molecular weight of 2,6-Dichlorophenyl valerate?
The molecular weight of 2,6-Dichlorophenyl valerate is 246.02 g/mol.
Where can I buy 2,6-Dichlorophenyl valerate?
You can request a quote for 2,6-Dichlorophenyl valerate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dichlorophenyl valerate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dichlorophenyl valerate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.