1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene
TL;DR: 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene (CAS 90985-94-7) is a chemical compound with molecular formula C13H7Cl5O2 and molecular weight 369.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,5-trichloro-2-(3,5-dichloro-4-methoxyphenoxy)benzene
Also Known As: 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene, J1.598.256J, 2,6-DICHLORO-4-(2,4,6-TRICHLOROPHENOXY)ANISOLE, 1,3,5-trichloro-2-(3,5-dichloro-4-methoxyphenoxy)benzene
| Molecular Formula | C13H7Cl5O2 |
|---|---|
| Molecular Weight | 369.89 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.88593 |
| Heavy Atoms | 20 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 90985-94-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1Cl)OC2=C(C=C(C=C2Cl)Cl)Cl)Cl |
| InChIKey | UZSFJBPWIONKLW-UHFFFAOYSA-N |
Product Overview
1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene (CAS 90985-94-7), with molecular formula C13H7Cl5O2 and molecular weight 369.89 g/mol. IUPAC: 1,3,5-trichloro-2-(3,5-dichloro-4-methoxyphenoxy)benzene.
Chemical Property Profile of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene
Property Insights of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene
The XLogP value of 6.6 indicates that 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene?
The CAS number of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene is 90985-94-7.
What is the molecular formula of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene?
The molecular formula of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene is C13H7Cl5O2.
What is the molecular weight of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene?
The molecular weight of 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene is 369.89 g/mol.
Where can I buy 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene?
You can request a quote for 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dichloro-2-methoxy-5-(2,4,6-trichlorophenoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.