1,3-Dimethoxy-2,5-dimethylbenzene
TL;DR: 1,3-Dimethoxy-2,5-dimethylbenzene (CAS 21390-25-0) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethoxy-2,5-dimethylbenzene
Also Known As: 1,3-dimethoxy-2,5-dimethylbenzene, 2,6-Dimethoxy-p-xylene, Benzene, 1,3-dimethoxy-2,5-dimethyl, WT569, 0873AB
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 21390-25-0 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)OC)C)OC |
| InChIKey | GIUXLBFXMAOOQJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dimethoxy-2,5-dimethylbenzene (CAS 21390-25-0), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 1,3-dimethoxy-2,5-dimethylbenzene.
Chemical Property Profile of 1,3-Dimethoxy-2,5-dimethylbenzene
Property Insights of 1,3-Dimethoxy-2,5-dimethylbenzene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethoxy-2,5-dimethylbenzene. With a topological polar surface area (TPSA) of 18.5 Ų, 1,3-Dimethoxy-2,5-dimethylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethoxy-2,5-dimethylbenzene 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-Dimethoxy-2,5-dimethylbenzene?
The CAS number of 1,3-Dimethoxy-2,5-dimethylbenzene is 21390-25-0.
What is the molecular formula of 1,3-Dimethoxy-2,5-dimethylbenzene?
The molecular formula of 1,3-Dimethoxy-2,5-dimethylbenzene is C10H14O2.
What is the molecular weight of 1,3-Dimethoxy-2,5-dimethylbenzene?
The molecular weight of 1,3-Dimethoxy-2,5-dimethylbenzene is 166.10 g/mol.
Where can I buy 1,3-Dimethoxy-2,5-dimethylbenzene?
You can request a quote for 1,3-Dimethoxy-2,5-dimethylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethoxy-2,5-dimethylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethoxy-2,5-dimethylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.