Nonyl 3-chloropropanoate
TL;DR: Nonyl 3-chloropropanoate (CAS 74306-05-1) is a chemical compound with molecular formula C12H23ClO2 and molecular weight 234.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonyl 3-chloropropanoate
Also Known As: Nonyl 3-chloropropanoate, Nonyl 3-chloropropanoate #, 3-Chlropropionic acid, nonyl ester, Propanoic acid, 3-chloro, nonyl ester, Propanoic acid, 3-chloro-, nonyl ester
| Molecular Formula | C12H23ClO2 |
|---|---|
| Molecular Weight | 234.14 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 234.13866 |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 74306-05-1 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)CCCl |
| InChIKey | TVEXZMIDIHNANR-UHFFFAOYSA-N |
Product Overview
Nonyl 3-chloropropanoate (CAS 74306-05-1), with molecular formula C12H23ClO2 and molecular weight 234.14 g/mol. IUPAC: nonyl 3-chloropropanoate.
Chemical Property Profile of Nonyl 3-chloropropanoate
Property Insights of Nonyl 3-chloropropanoate
The XLogP value of 4.5 indicates that Nonyl 3-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, Nonyl 3-chloropropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonyl 3-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 Nonyl 3-chloropropanoate?
The CAS number of Nonyl 3-chloropropanoate is 74306-05-1.
What is the molecular formula of Nonyl 3-chloropropanoate?
The molecular formula of Nonyl 3-chloropropanoate is C12H23ClO2.
What is the molecular weight of Nonyl 3-chloropropanoate?
The molecular weight of Nonyl 3-chloropropanoate is 234.14 g/mol.
Where can I buy Nonyl 3-chloropropanoate?
You can request a quote for Nonyl 3-chloropropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonyl 3-chloropropanoate?
Yes, KEHONG BIO provides custom synthesis services for Nonyl 3-chloropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.