3,3',4,4',5-五氯二苯醚
TL;DR: 3,3',4,4',5-五氯二苯醚 (CAS 94339-59-0) is a chemical compound with molecular formula C12H5Cl5O and molecular weight 339.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3',4,4',5-五氯二苯醚
1,2,3-trichloro-5-(3,4-dichlorophenoxy)benzene
Also Known As: Arg-gly-asp, 3,3',4,4',5-Pentachlorodiphenyl ether, 1,2,3-trichloro-5-(3,4-dichlorophenoxy)benzene, Benzene, 1,2,3-trichloro-5-(3,4-dichlorophenoxy)-, 3,3 ,4,4 ,5-Pentachlorodiphenyl ether
| Molecular Formula | C12H5Cl5O |
|---|---|
| Molecular Weight | 339.88 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 341.87537 |
| Heavy Atoms | 18 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 94339-59-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1OC2=CC(=C(C(=C2)Cl)Cl)Cl)Cl)Cl |
| InChIKey | WDBLKMRZRGLISL-UHFFFAOYSA-N |
Product Overview
3,3',4,4',5-五氯二苯醚 (CAS 94339-59-0), with molecular formula C12H5Cl5O and molecular weight 339.88 g/mol. IUPAC: 1,2,3-trichloro-5-(3,4-dichlorophenoxy)benzene.
Chemical Property Profile of 3,3',4,4',5-五氯二苯醚
Property Insights of 3,3',4,4',5-五氯二苯醚
The XLogP value of 6.6 indicates that 3,3',4,4',5-五氯二苯醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 3,3',4,4',5-五氯二苯醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3',4,4',5-五氯二苯醚 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 3,3',4,4',5-五氯二苯醚?
The CAS number of 3,3',4,4',5-五氯二苯醚 is 94339-59-0.
What is the molecular formula of 3,3',4,4',5-五氯二苯醚?
The molecular formula of 3,3',4,4',5-五氯二苯醚 is C12H5Cl5O.
What is the molecular weight of 3,3',4,4',5-五氯二苯醚?
The molecular weight of 3,3',4,4',5-五氯二苯醚 is 339.88 g/mol.
Where can I buy 3,3',4,4',5-五氯二苯醚?
You can request a quote for 3,3',4,4',5-五氯二苯醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3',4,4',5-五氯二苯醚?
Yes, KEHONG BIO provides custom synthesis services for 3,3',4,4',5-五氯二苯醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.