1-(Diethoxymethyl)-2-methoxybenzene
TL;DR: 1-(Diethoxymethyl)-2-methoxybenzene (CAS 6989-79-3) is a chemical compound with molecular formula C12H18O3 and molecular weight 210.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diethoxymethyl)-2-methoxybenzene
Also Known As: 1-(diethoxymethyl)-2-methoxybenzene, methoxybenzaldehyde diethyl acetal, 1-Diethoxymethyl-2-methoxybenzene, 2-Methoxybenzaldehyde diethyl acetal, Benzene, 1-(diethoxymethyl)-2-methoxy-
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.13 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 155.0 |
Chemical Identifiers
| CAS Number | 6989-79-3 |
|---|---|
| SMILES | CCOC(C1=CC=CC=C1OC)OCC |
| InChIKey | GXARMCJYOUZXEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Diethoxymethyl)-2-methoxybenzene (CAS 6989-79-3), with molecular formula C12H18O3 and molecular weight 210.13 g/mol. IUPAC: 1-(diethoxymethyl)-2-methoxybenzene.
Chemical Property Profile of 1-(Diethoxymethyl)-2-methoxybenzene
Property Insights of 1-(Diethoxymethyl)-2-methoxybenzene
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Diethoxymethyl)-2-methoxybenzene. With a topological polar surface area (TPSA) of 27.7 Ų, 1-(Diethoxymethyl)-2-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Diethoxymethyl)-2-methoxybenzene has 0 hydrogen bond donor(s) and 3 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-(Diethoxymethyl)-2-methoxybenzene?
The CAS number of 1-(Diethoxymethyl)-2-methoxybenzene is 6989-79-3.
What is the molecular formula of 1-(Diethoxymethyl)-2-methoxybenzene?
The molecular formula of 1-(Diethoxymethyl)-2-methoxybenzene is C12H18O3.
What is the molecular weight of 1-(Diethoxymethyl)-2-methoxybenzene?
The molecular weight of 1-(Diethoxymethyl)-2-methoxybenzene is 210.13 g/mol.
Where can I buy 1-(Diethoxymethyl)-2-methoxybenzene?
You can request a quote for 1-(Diethoxymethyl)-2-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Diethoxymethyl)-2-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Diethoxymethyl)-2-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.