Heptyl 2,4-dichlorophenoxyacetate
TL;DR: Heptyl 2,4-dichlorophenoxyacetate (CAS 1917-96-0) is a chemical compound with molecular formula C15H20Cl2O3 and molecular weight 318.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl 2-(2,4-dichlorophenoxy)acetate
Also Known As: Heptyl 2,4-dichlorophenoxyacetate, heptyl 2-(2,4-dichlorophenoxy)acetate, heptyl(2,4-dichlorophenoxy)acetate, heptyl 2,4-dichloro-phenoxyacetate, heptyl-2,4-dichloro-phenoxyacetate
| Molecular Formula | C15H20Cl2O3 |
|---|---|
| Molecular Weight | 318.08 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 318.07895 |
| Heavy Atoms | 20 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 1917-96-0 |
|---|---|
| SMILES | CCCCCCCOC(=O)COC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | HZQJGWTYZAWPLJ-UHFFFAOYSA-N |
Product Overview
Heptyl 2,4-dichlorophenoxyacetate (CAS 1917-96-0), with molecular formula C15H20Cl2O3 and molecular weight 318.08 g/mol. IUPAC: heptyl 2-(2,4-dichlorophenoxy)acetate.
Chemical Property Profile of Heptyl 2,4-dichlorophenoxyacetate
Property Insights of Heptyl 2,4-dichlorophenoxyacetate
The XLogP value of 6.0 indicates that Heptyl 2,4-dichlorophenoxyacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Heptyl 2,4-dichlorophenoxyacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl 2,4-dichlorophenoxyacetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Heptyl 2,4-dichlorophenoxyacetate?
The CAS number of Heptyl 2,4-dichlorophenoxyacetate is 1917-96-0.
What is the molecular formula of Heptyl 2,4-dichlorophenoxyacetate?
The molecular formula of Heptyl 2,4-dichlorophenoxyacetate is C15H20Cl2O3.
What is the molecular weight of Heptyl 2,4-dichlorophenoxyacetate?
The molecular weight of Heptyl 2,4-dichlorophenoxyacetate is 318.08 g/mol.
Where can I buy Heptyl 2,4-dichlorophenoxyacetate?
You can request a quote for Heptyl 2,4-dichlorophenoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl 2,4-dichlorophenoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl 2,4-dichlorophenoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.