2-Chloro-2-(diethoxymethyl)-3-phenyloxirane
TL;DR: 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane (CAS 175983-10-5) is a chemical compound with molecular formula C13H17ClO3 and molecular weight 256.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-2-(diethoxymethyl)-3-phenyloxirane
Also Known As: 2-chloro-2-(diethoxymethyl)-3-phenyloxirane, 2-Phenyl-3-chloro-3-(diethoxymethyl)oxirane, 2-chloro-2-(diethoxymethyl)-3-phenyl-oxirane, J1.045.401H
| Molecular Formula | C13H17ClO3 |
|---|---|
| Molecular Weight | 256.09 g/mol |
| LogP | 3.0921 |
| Topological Polar Surface Area | 30.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 256.0866 |
| Heavy Atoms | 17 |
| Complexity | 350.94202 |
Chemical Identifiers
| CAS Number | 175983-10-5 |
|---|---|
| SMILES | CCOC(C1(C(O1)C2=CC=CC=C2)Cl)OCC |
Product Overview
2-Chloro-2-(diethoxymethyl)-3-phenyloxirane (CAS 175983-10-5), with molecular formula C13H17ClO3 and molecular weight 256.09 g/mol. IUPAC: 2-chloro-2-(diethoxymethyl)-3-phenyloxirane.
Chemical Property Profile of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane
Property Insights of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane
The XLogP value of 3.0921 indicates that 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.99 Ų, 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane has 0 hydrogen bond donor(s) and 3 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 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane?
The CAS number of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane is 175983-10-5.
What is the molecular formula of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane?
The molecular formula of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane is C13H17ClO3.
What is the molecular weight of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane?
The molecular weight of 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane is 256.09 g/mol.
Where can I buy 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane?
You can request a quote for 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-2-(diethoxymethyl)-3-phenyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.