Benzene, 1,3-dimethoxy-5-ethyl
TL;DR: Benzene, 1,3-dimethoxy-5-ethyl (CAS 51768-56-0) 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-ethyl-3,5-dimethoxybenzene
Also Known As: 1-ethyl-3,5-dimethoxybenzene, Benzene, 1,3-dimethoxy-5-ethyl, 1,3-dimethoxy-5-ethylbenzene, Benzene,1,3-dimethoxy-5-ethyl, Benzene, 1-ethyl-3,5-dimethoxy-
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 113.0 |
Chemical Identifiers
| CAS Number | 51768-56-0 |
|---|---|
| SMILES | CCC1=CC(=CC(=C1)OC)OC |
| InChIKey | CDQDCHVJLUPXEF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzene, 1,3-dimethoxy-5-ethyl (CAS 51768-56-0), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 1-ethyl-3,5-dimethoxybenzene.
Chemical Property Profile of Benzene, 1,3-dimethoxy-5-ethyl
Property Insights of Benzene, 1,3-dimethoxy-5-ethyl
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzene, 1,3-dimethoxy-5-ethyl. With a topological polar surface area (TPSA) of 18.5 Ų, Benzene, 1,3-dimethoxy-5-ethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzene, 1,3-dimethoxy-5-ethyl 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 Benzene, 1,3-dimethoxy-5-ethyl?
The CAS number of Benzene, 1,3-dimethoxy-5-ethyl is 51768-56-0.
What is the molecular formula of Benzene, 1,3-dimethoxy-5-ethyl?
The molecular formula of Benzene, 1,3-dimethoxy-5-ethyl is C10H14O2.
What is the molecular weight of Benzene, 1,3-dimethoxy-5-ethyl?
The molecular weight of Benzene, 1,3-dimethoxy-5-ethyl is 166.10 g/mol.
Where can I buy Benzene, 1,3-dimethoxy-5-ethyl?
You can request a quote for Benzene, 1,3-dimethoxy-5-ethyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzene, 1,3-dimethoxy-5-ethyl?
Yes, KEHONG BIO provides custom synthesis services for Benzene, 1,3-dimethoxy-5-ethyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.