2-[(Pentachlorophenoxy)methyl]oxirane
TL;DR: 2-[(Pentachlorophenoxy)methyl]oxirane (CAS 437-83-2) is a chemical compound with molecular formula C9H5Cl5O2 and molecular weight 319.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2,3,4,5,6-pentachlorophenoxy)methyl]oxirane
Also Known As: 3-Fluoro-2-methoxyaniline, 2-[(pentachlorophenoxy)methyl]oxirane, 3-fluoro-2-methoxybenzenamine, pentachlorophenyl glycidyl ether, 3-
| Molecular Formula | C9H5Cl5O2 |
|---|---|
| Molecular Weight | 319.87 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.87323 |
| Heavy Atoms | 16 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 437-83-2 |
|---|---|
| SMILES | C1C(O1)COC2=C(C(=C(C(=C2Cl)Cl)Cl)Cl)Cl |
| InChIKey | PFDCHZHXWKDTRX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-[(Pentachlorophenoxy)methyl]oxirane (CAS 437-83-2), with molecular formula C9H5Cl5O2 and molecular weight 319.87 g/mol. IUPAC: 2-[(2,3,4,5,6-pentachlorophenoxy)methyl]oxirane.
Chemical Property Profile of 2-[(Pentachlorophenoxy)methyl]oxirane
Property Insights of 2-[(Pentachlorophenoxy)methyl]oxirane
The XLogP value of 4.7 indicates that 2-[(Pentachlorophenoxy)methyl]oxirane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.8 Ų, 2-[(Pentachlorophenoxy)methyl]oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Pentachlorophenoxy)methyl]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-[(Pentachlorophenoxy)methyl]oxirane?
The CAS number of 2-[(Pentachlorophenoxy)methyl]oxirane is 437-83-2.
What is the molecular formula of 2-[(Pentachlorophenoxy)methyl]oxirane?
The molecular formula of 2-[(Pentachlorophenoxy)methyl]oxirane is C9H5Cl5O2.
What is the molecular weight of 2-[(Pentachlorophenoxy)methyl]oxirane?
The molecular weight of 2-[(Pentachlorophenoxy)methyl]oxirane is 319.87 g/mol.
Where can I buy 2-[(Pentachlorophenoxy)methyl]oxirane?
You can request a quote for 2-[(Pentachlorophenoxy)methyl]oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Pentachlorophenoxy)methyl]oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Pentachlorophenoxy)methyl]oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.