2-(2-Chloroprop-2-enoxymethyl)oxirane
TL;DR: 2-(2-Chloroprop-2-enoxymethyl)oxirane (CAS 59778-10-8) is a chemical compound with molecular formula C6H9ClO2 and molecular weight 148.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloroprop-2-enoxymethyl)oxirane
Also Known As: 2-(2-chloroallyloxymethyl)oxirane, 2-(2-chloroprop-2-enoxymethyl)oxirane, 2-{[(2-chloroprop-2-en-1-yl)oxy]methyl}oxirane, Oxirane,2-[[(2-chloro-2-propen-1-yl)oxy]methyl]-, 2-chloro-3-(1(3)H-imidazol-4-yl)-propionic acid methyl ester
| Molecular Formula | C6H9ClO2 |
|---|---|
| Molecular Weight | 148.03 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 148.02911 |
| Heavy Atoms | 9 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 59778-10-8 |
|---|---|
| SMILES | C=C(COCC1CO1)Cl |
| InChIKey | NNOVSMDASPKCQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(2-Chloroprop-2-enoxymethyl)oxirane (CAS 59778-10-8), with molecular formula C6H9ClO2 and molecular weight 148.03 g/mol. IUPAC: 2-(2-chloroprop-2-enoxymethyl)oxirane.
Chemical Property Profile of 2-(2-Chloroprop-2-enoxymethyl)oxirane
Property Insights of 2-(2-Chloroprop-2-enoxymethyl)oxirane
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Chloroprop-2-enoxymethyl)oxirane. With a topological polar surface area (TPSA) of 21.8 Ų, 2-(2-Chloroprop-2-enoxymethyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Chloroprop-2-enoxymethyl)oxirane 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 2-(2-Chloroprop-2-enoxymethyl)oxirane?
The CAS number of 2-(2-Chloroprop-2-enoxymethyl)oxirane is 59778-10-8.
What is the molecular formula of 2-(2-Chloroprop-2-enoxymethyl)oxirane?
The molecular formula of 2-(2-Chloroprop-2-enoxymethyl)oxirane is C6H9ClO2.
What is the molecular weight of 2-(2-Chloroprop-2-enoxymethyl)oxirane?
The molecular weight of 2-(2-Chloroprop-2-enoxymethyl)oxirane is 148.03 g/mol.
Where can I buy 2-(2-Chloroprop-2-enoxymethyl)oxirane?
You can request a quote for 2-(2-Chloroprop-2-enoxymethyl)oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Chloroprop-2-enoxymethyl)oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Chloroprop-2-enoxymethyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.