Propanoic acid, 2,2-dichloro-, pentyl ester
TL;DR: Propanoic acid, 2,2-dichloro-, pentyl ester (CAS 17640-08-3) 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.
pentyl 2,2-dichloropropanoate
Also Known As: Pentyl 2,2-dichloropropanoate, Propanoic acid, 2,2-dichloro-, pentyl ester, Pentyl 2,2-dichloropropanoate #, Propionic acid, 2,2-dichloro-, pentyl ester, 2,2-Dichloropropionic acid pentyl ester
| Molecular Formula | C8H14Cl2O2 |
|---|---|
| Molecular Weight | 212.04 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 212.03708 |
| Heavy Atoms | 12 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 17640-08-3 |
|---|---|
| SMILES | CCCCCOC(=O)C(C)(Cl)Cl |
| InChIKey | ZCPOSLAFHCNHBE-UHFFFAOYSA-N |
Product Overview
Propanoic acid, 2,2-dichloro-, pentyl ester (CAS 17640-08-3), with molecular formula C8H14Cl2O2 and molecular weight 212.04 g/mol. IUPAC: pentyl 2,2-dichloropropanoate.
Chemical Property Profile of Propanoic acid, 2,2-dichloro-, pentyl ester
Property Insights of Propanoic acid, 2,2-dichloro-, pentyl ester
The XLogP value of 3.4 indicates that Propanoic acid, 2,2-dichloro-, pentyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Propanoic acid, 2,2-dichloro-, pentyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 2,2-dichloro-, pentyl ester 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 Propanoic acid, 2,2-dichloro-, pentyl ester?
The CAS number of Propanoic acid, 2,2-dichloro-, pentyl ester is 17640-08-3.
What is the molecular formula of Propanoic acid, 2,2-dichloro-, pentyl ester?
The molecular formula of Propanoic acid, 2,2-dichloro-, pentyl ester is C8H14Cl2O2.
What is the molecular weight of Propanoic acid, 2,2-dichloro-, pentyl ester?
The molecular weight of Propanoic acid, 2,2-dichloro-, pentyl ester is 212.04 g/mol.
Where can I buy Propanoic acid, 2,2-dichloro-, pentyl ester?
You can request a quote for Propanoic acid, 2,2-dichloro-, pentyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 2,2-dichloro-, pentyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 2,2-dichloro-, pentyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.