(1,2-Dimethoxyethyl)benzene
TL;DR: (1,2-Dimethoxyethyl)benzene (CAS 4013-37-0) 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.
1,2-dimethoxyethylbenzene
Also Known As: 1,2-dimethoxyethylbenzene, Benzene, (1,2-dimethoxyethyl)-, (1,2-Dimethoxyethyl)benzene, 1-Phenyl-1,2-dimethoxyethane, 1,2-Dimethoxy-1-phenylethane
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 4013-37-0 |
|---|---|
| SMILES | COCC(C1=CC=CC=C1)OC |
| InChIKey | MCZSDTLZJNZORX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(1,2-Dimethoxyethyl)benzene (CAS 4013-37-0), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 1,2-dimethoxyethylbenzene.
Chemical Property Profile of (1,2-Dimethoxyethyl)benzene
Property Insights of (1,2-Dimethoxyethyl)benzene
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,2-Dimethoxyethyl)benzene. With a topological polar surface area (TPSA) of 18.5 Ų, (1,2-Dimethoxyethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1,2-Dimethoxyethyl)benzene 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 (1,2-Dimethoxyethyl)benzene?
The CAS number of (1,2-Dimethoxyethyl)benzene is 4013-37-0.
What is the molecular formula of (1,2-Dimethoxyethyl)benzene?
The molecular formula of (1,2-Dimethoxyethyl)benzene is C10H14O2.
What is the molecular weight of (1,2-Dimethoxyethyl)benzene?
The molecular weight of (1,2-Dimethoxyethyl)benzene is 166.10 g/mol.
Where can I buy (1,2-Dimethoxyethyl)benzene?
You can request a quote for (1,2-Dimethoxyethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,2-Dimethoxyethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (1,2-Dimethoxyethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.