1,3,4-Trichloro-2,5-dimethoxybenzene
TL;DR: 1,3,4-Trichloro-2,5-dimethoxybenzene (CAS 69653-71-0) is a chemical compound with molecular formula C8H7Cl3O2 and molecular weight 239.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3,4-trichloro-2,5-dimethoxybenzene
Also Known As: Trichloro-1,4-dimethoxybenzene, 1,3,4-Trichloro-2,5-dimethoxybenzene, Benzene, trichlorodimethoxy-, 2,5-Dimethoxy-1,3,4-trichlorobenzene, TRICHLORODIMETHOXYBENZENE
| Molecular Formula | C8H7Cl3O2 |
|---|---|
| Molecular Weight | 239.95 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.95116 |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 69653-71-0 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1Cl)Cl)OC)Cl |
| InChIKey | DUFMNUZVJOWJAI-UHFFFAOYSA-N |
Product Overview
1,3,4-Trichloro-2,5-dimethoxybenzene (CAS 69653-71-0), with molecular formula C8H7Cl3O2 and molecular weight 239.95 g/mol. IUPAC: 1,3,4-trichloro-2,5-dimethoxybenzene.
Chemical Property Profile of 1,3,4-Trichloro-2,5-dimethoxybenzene
Property Insights of 1,3,4-Trichloro-2,5-dimethoxybenzene
The XLogP value of 4.1 indicates that 1,3,4-Trichloro-2,5-dimethoxybenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3,4-Trichloro-2,5-dimethoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,4-Trichloro-2,5-dimethoxybenzene 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 1,3,4-Trichloro-2,5-dimethoxybenzene?
The CAS number of 1,3,4-Trichloro-2,5-dimethoxybenzene is 69653-71-0.
What is the molecular formula of 1,3,4-Trichloro-2,5-dimethoxybenzene?
The molecular formula of 1,3,4-Trichloro-2,5-dimethoxybenzene is C8H7Cl3O2.
What is the molecular weight of 1,3,4-Trichloro-2,5-dimethoxybenzene?
The molecular weight of 1,3,4-Trichloro-2,5-dimethoxybenzene is 239.95 g/mol.
Where can I buy 1,3,4-Trichloro-2,5-dimethoxybenzene?
You can request a quote for 1,3,4-Trichloro-2,5-dimethoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,4-Trichloro-2,5-dimethoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3,4-Trichloro-2,5-dimethoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.