Valeric acid, 2-propyl-, 2-chloroethyl ester
TL;DR: Valeric acid, 2-propyl-, 2-chloroethyl ester (CAS 2593-55-7) is a chemical compound with molecular formula C10H19ClO2 and molecular weight 206.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl 2-propylpentanoate
Also Known As: 2-chloroethyl 2-propylpentanoate, 2-Chloroethyl 2-propylvalerate, 2-Propylvaleric acid 2-chloroethyl ester, Valeric acid, 2-propyl-, 2-chloroethyl ester, Pentanoic acid, 2-propyl-, 2-chloroethyl ester
| Molecular Formula | C10H19ClO2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 206.10736 |
| Heavy Atoms | 13 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 2593-55-7 |
|---|---|
| SMILES | CCCC(CCC)C(=O)OCCCl |
| InChIKey | FJMRULIIMVRJHI-UHFFFAOYSA-N |
Product Overview
Valeric acid, 2-propyl-, 2-chloroethyl ester (CAS 2593-55-7), with molecular formula C10H19ClO2 and molecular weight 206.11 g/mol. IUPAC: 2-chloroethyl 2-propylpentanoate.
Chemical Property Profile of Valeric acid, 2-propyl-, 2-chloroethyl ester
Property Insights of Valeric acid, 2-propyl-, 2-chloroethyl ester
The XLogP value of 3.5 indicates that Valeric acid, 2-propyl-, 2-chloroethyl 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, Valeric acid, 2-propyl-, 2-chloroethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Valeric acid, 2-propyl-, 2-chloroethyl 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 Valeric acid, 2-propyl-, 2-chloroethyl ester?
The CAS number of Valeric acid, 2-propyl-, 2-chloroethyl ester is 2593-55-7.
What is the molecular formula of Valeric acid, 2-propyl-, 2-chloroethyl ester?
The molecular formula of Valeric acid, 2-propyl-, 2-chloroethyl ester is C10H19ClO2.
What is the molecular weight of Valeric acid, 2-propyl-, 2-chloroethyl ester?
The molecular weight of Valeric acid, 2-propyl-, 2-chloroethyl ester is 206.11 g/mol.
Where can I buy Valeric acid, 2-propyl-, 2-chloroethyl ester?
You can request a quote for Valeric acid, 2-propyl-, 2-chloroethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Valeric acid, 2-propyl-, 2-chloroethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Valeric acid, 2-propyl-, 2-chloroethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.