2,3,3',4,4',5'-Hexachlorodiphenyl ether
TL;DR: 2,3,3',4,4',5'-Hexachlorodiphenyl ether (CAS 94339-60-3) is a chemical compound with molecular formula C12H4Cl6O and molecular weight 373.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3-trichloro-4-(3,4,5-trichlorophenoxy)benzene
Also Known As: Mesigyna, PCDE 157, Hrp 102, 2,3,3',4,4',5'-Hexachlorodiphenyl ether, KST-1B9585
| Molecular Formula | C12H4Cl6O |
|---|---|
| Molecular Weight | 373.84 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 375.8364 |
| Heavy Atoms | 19 |
| Complexity | 292.0 |
Chemical Identifiers
| CAS Number | 94339-60-3 |
|---|---|
| SMILES | C1=CC(=C(C(=C1OC2=CC(=C(C(=C2)Cl)Cl)Cl)Cl)Cl)Cl |
| InChIKey | FEIDIWDEJQVIPO-UHFFFAOYSA-N |
Product Overview
2,3,3',4,4',5'-Hexachlorodiphenyl ether (CAS 94339-60-3), with molecular formula C12H4Cl6O and molecular weight 373.84 g/mol. IUPAC: 1,2,3-trichloro-4-(3,4,5-trichlorophenoxy)benzene.
Chemical Property Profile of 2,3,3',4,4',5'-Hexachlorodiphenyl ether
Property Insights of 2,3,3',4,4',5'-Hexachlorodiphenyl ether
The XLogP value of 7.2 indicates that 2,3,3',4,4',5'-Hexachlorodiphenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 2,3,3',4,4',5'-Hexachlorodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,3',4,4',5'-Hexachlorodiphenyl ether has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,3',4,4',5'-Hexachlorodiphenyl ether?
The CAS number of 2,3,3',4,4',5'-Hexachlorodiphenyl ether is 94339-60-3.
What is the molecular formula of 2,3,3',4,4',5'-Hexachlorodiphenyl ether?
The molecular formula of 2,3,3',4,4',5'-Hexachlorodiphenyl ether is C12H4Cl6O.
What is the molecular weight of 2,3,3',4,4',5'-Hexachlorodiphenyl ether?
The molecular weight of 2,3,3',4,4',5'-Hexachlorodiphenyl ether is 373.84 g/mol.
Where can I buy 2,3,3',4,4',5'-Hexachlorodiphenyl ether?
You can request a quote for 2,3,3',4,4',5'-Hexachlorodiphenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,3',4,4',5'-Hexachlorodiphenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 2,3,3',4,4',5'-Hexachlorodiphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.