Heptyl 2-chloropropanoate
TL;DR: Heptyl 2-chloropropanoate (CAS 86711-77-5) 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.
heptyl 2-chloropropanoate
Also Known As: Heptyl 2-chloropropanoate, Propanoic acid, 2-chloro, heptyl ester, Propanoic acid,2-chloro,heptyl ester, Propanoic acid, 2-chloro-, heptyl ester, RefChem:347300
| Molecular Formula | C10H19ClO2 |
|---|---|
| Molecular Weight | 206.11 g/mol |
| LogP | 4.0 |
| 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 | 137.0 |
Chemical Identifiers
| CAS Number | 86711-77-5 |
|---|---|
| SMILES | CCCCCCCOC(=O)C(C)Cl |
| InChIKey | UFPPPJHAPGEPCE-UHFFFAOYSA-N |
Product Overview
Heptyl 2-chloropropanoate (CAS 86711-77-5), with molecular formula C10H19ClO2 and molecular weight 206.11 g/mol. IUPAC: heptyl 2-chloropropanoate.
Chemical Property Profile of Heptyl 2-chloropropanoate
Property Insights of Heptyl 2-chloropropanoate
The XLogP value of 4.0 indicates that Heptyl 2-chloropropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Heptyl 2-chloropropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl 2-chloropropanoate 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 Heptyl 2-chloropropanoate?
The CAS number of Heptyl 2-chloropropanoate is 86711-77-5.
What is the molecular formula of Heptyl 2-chloropropanoate?
The molecular formula of Heptyl 2-chloropropanoate is C10H19ClO2.
What is the molecular weight of Heptyl 2-chloropropanoate?
The molecular weight of Heptyl 2-chloropropanoate is 206.11 g/mol.
Where can I buy Heptyl 2-chloropropanoate?
You can request a quote for Heptyl 2-chloropropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl 2-chloropropanoate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl 2-chloropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.