3-(3-Phenoxypropoxy)propyl chloroacetate
TL;DR: 3-(3-Phenoxypropoxy)propyl chloroacetate (CAS 69507-30-8) is a chemical compound with molecular formula C14H19ClO4 and molecular weight 286.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-phenoxypropoxy)propyl 2-chloroacetate
Also Known As: 3-(3-phenoxypropoxy)propyl chloroacetate, 3-Butyn-2-ol,phenylcarbamate, 3-[3-(phenoxy)propoxy]propyl 2-chloroaceta, 3-(3-phenoxypropoxy)propyl 2-chloroacetate
| Molecular Formula | C14H19ClO4 |
|---|---|
| Molecular Weight | 286.10 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 286.0972 |
| Heavy Atoms | 19 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 69507-30-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OCCCOCCCOC(=O)CCl |
| InChIKey | FKFNXVLTZWQGHV-UHFFFAOYSA-N |
Product Overview
3-(3-Phenoxypropoxy)propyl chloroacetate (CAS 69507-30-8), with molecular formula C14H19ClO4 and molecular weight 286.10 g/mol. IUPAC: 3-(3-phenoxypropoxy)propyl 2-chloroacetate.
Chemical Property Profile of 3-(3-Phenoxypropoxy)propyl chloroacetate
Property Insights of 3-(3-Phenoxypropoxy)propyl chloroacetate
The XLogP value of 3.0 indicates that 3-(3-Phenoxypropoxy)propyl chloroacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.8 Ų, 3-(3-Phenoxypropoxy)propyl chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3-Phenoxypropoxy)propyl chloroacetate has 0 hydrogen bond donor(s) and 4 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 3-(3-Phenoxypropoxy)propyl chloroacetate?
The CAS number of 3-(3-Phenoxypropoxy)propyl chloroacetate is 69507-30-8.
What is the molecular formula of 3-(3-Phenoxypropoxy)propyl chloroacetate?
The molecular formula of 3-(3-Phenoxypropoxy)propyl chloroacetate is C14H19ClO4.
What is the molecular weight of 3-(3-Phenoxypropoxy)propyl chloroacetate?
The molecular weight of 3-(3-Phenoxypropoxy)propyl chloroacetate is 286.10 g/mol.
Where can I buy 3-(3-Phenoxypropoxy)propyl chloroacetate?
You can request a quote for 3-(3-Phenoxypropoxy)propyl chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Phenoxypropoxy)propyl chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Phenoxypropoxy)propyl chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.