(2,2,2-Triethoxyethyl)benzene
TL;DR: (2,2,2-Triethoxyethyl)benzene (CAS 16754-56-6) is a chemical compound with molecular formula C14H22O3 and molecular weight 238.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-triethoxyethylbenzene
Also Known As: (2,2,2-Triethoxyethyl)benzene, 2,2,2-triethoxyethylbenzene, Benzene, (2,2,2-triethoxyethyl)-, Triethyl orthophenylacetate, Triethyl phenylorthoacetate
| Molecular Formula | C14H22O3 |
|---|---|
| Molecular Weight | 238.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 238.15689 |
| Heavy Atoms | 17 |
| Complexity | 171.0 |
Chemical Identifiers
| CAS Number | 16754-56-6 |
|---|---|
| SMILES | CCOC(CC1=CC=CC=C1)(OCC)OCC |
| InChIKey | VFBUQMFVSOSLNV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2,2,2-Triethoxyethyl)benzene (CAS 16754-56-6), with molecular formula C14H22O3 and molecular weight 238.16 g/mol. IUPAC: 2,2,2-triethoxyethylbenzene.
Chemical Property Profile of (2,2,2-Triethoxyethyl)benzene
Property Insights of (2,2,2-Triethoxyethyl)benzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,2,2-Triethoxyethyl)benzene. With a topological polar surface area (TPSA) of 27.7 Ų, (2,2,2-Triethoxyethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,2,2-Triethoxyethyl)benzene 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 (2,2,2-Triethoxyethyl)benzene?
The CAS number of (2,2,2-Triethoxyethyl)benzene is 16754-56-6.
What is the molecular formula of (2,2,2-Triethoxyethyl)benzene?
The molecular formula of (2,2,2-Triethoxyethyl)benzene is C14H22O3.
What is the molecular weight of (2,2,2-Triethoxyethyl)benzene?
The molecular weight of (2,2,2-Triethoxyethyl)benzene is 238.16 g/mol.
Where can I buy (2,2,2-Triethoxyethyl)benzene?
You can request a quote for (2,2,2-Triethoxyethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,2,2-Triethoxyethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for (2,2,2-Triethoxyethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.