2,3-Dichloropropyl pentanoate
TL;DR: 2,3-Dichloropropyl pentanoate (CAS 88606-60-4) is a chemical compound with molecular formula C8H14Cl2O2 and molecular weight 212.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dichloropropyl pentanoate
Also Known As: 2,3-Dichloropropyl pentanoate, Pentanoic acid, 2,3-dichloropropyl ester, 1-Propanol, 2,3-dichloro, pentanoate, RefChem:244590
| Molecular Formula | C8H14Cl2O2 |
|---|---|
| Molecular Weight | 212.04 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 212.03708 |
| Heavy Atoms | 12 |
| Complexity | 128.0 |
Chemical Identifiers
| CAS Number | 88606-60-4 |
|---|---|
| SMILES | CCCCC(=O)OCC(CCl)Cl |
| InChIKey | XGGHUGCLFXEBED-UHFFFAOYSA-N |
Product Overview
2,3-Dichloropropyl pentanoate (CAS 88606-60-4), with molecular formula C8H14Cl2O2 and molecular weight 212.04 g/mol. IUPAC: 2,3-dichloropropyl pentanoate.
Chemical Property Profile of 2,3-Dichloropropyl pentanoate
Property Insights of 2,3-Dichloropropyl pentanoate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dichloropropyl pentanoate. With a topological polar surface area (TPSA) of 26.3 Ų, 2,3-Dichloropropyl pentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dichloropropyl pentanoate 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 2,3-Dichloropropyl pentanoate?
The CAS number of 2,3-Dichloropropyl pentanoate is 88606-60-4.
What is the molecular formula of 2,3-Dichloropropyl pentanoate?
The molecular formula of 2,3-Dichloropropyl pentanoate is C8H14Cl2O2.
What is the molecular weight of 2,3-Dichloropropyl pentanoate?
The molecular weight of 2,3-Dichloropropyl pentanoate is 212.04 g/mol.
Where can I buy 2,3-Dichloropropyl pentanoate?
You can request a quote for 2,3-Dichloropropyl pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dichloropropyl pentanoate?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dichloropropyl pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.