Undecyl 4-chlorobenzoate
TL;DR: Undecyl 4-chlorobenzoate (CAS 6317-73-3) is a chemical compound with molecular formula C18H27ClO2 and molecular weight 310.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
undecyl 4-chlorobenzoate
Also Known As: Undecyl 4-chlorobenzoate, Undecyl 4-chlorobenzoate #, 4-Chlorobenzoicacid,undecylester, 4-Chlorobenzoic acid, undecyl ester, 4-Chlorobenzoic acid,undecyl ester
| Molecular Formula | C18H27ClO2 |
|---|---|
| Molecular Weight | 310.17 g/mol |
| LogP | 8.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Exact Mass | 310.16995 |
| Heavy Atoms | 21 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 6317-73-3 |
|---|---|
| SMILES | CCCCCCCCCCCOC(=O)C1=CC=C(C=C1)Cl |
| InChIKey | MEWVVEWZGJOCOB-UHFFFAOYSA-N |
Product Overview
Undecyl 4-chlorobenzoate (CAS 6317-73-3), with molecular formula C18H27ClO2 and molecular weight 310.17 g/mol. IUPAC: undecyl 4-chlorobenzoate.
Chemical Property Profile of Undecyl 4-chlorobenzoate
Property Insights of Undecyl 4-chlorobenzoate
The XLogP value of 8.0 indicates that Undecyl 4-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Undecyl 4-chlorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Undecyl 4-chlorobenzoate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Undecyl 4-chlorobenzoate?
The CAS number of Undecyl 4-chlorobenzoate is 6317-73-3.
What is the molecular formula of Undecyl 4-chlorobenzoate?
The molecular formula of Undecyl 4-chlorobenzoate is C18H27ClO2.
What is the molecular weight of Undecyl 4-chlorobenzoate?
The molecular weight of Undecyl 4-chlorobenzoate is 310.17 g/mol.
Where can I buy Undecyl 4-chlorobenzoate?
You can request a quote for Undecyl 4-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Undecyl 4-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for Undecyl 4-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.