Ethanol, 2-(1,4-benzodioxan-2-yl)-
TL;DR: Ethanol, 2-(1,4-benzodioxan-2-yl)- (CAS 62590-71-0) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanol
Also Known As: 2-(1,4-Benzodioxan-2-yl)ethanol, 2-(2,3-dihydro-1,4-benzodioxin-2-yl)ethanol, 2-(2,3-Dihydrobenzo[b][1,4]dioxin-2-yl)ethanol, 2-hydroxyethyl-l,4-benzodioxan, CHEMBRDG-BB 4015698
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 62590-71-0 |
|---|---|
| SMILES | C1C(OC2=CC=CC=C2O1)CCO |
| InChIKey | VRCHCDXHBXLNKZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanol, 2-(1,4-benzodioxan-2-yl)- (CAS 62590-71-0), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 2-(2,3-dihydro-1,4-benzodioxin-3-yl)ethanol.
Chemical Property Profile of Ethanol, 2-(1,4-benzodioxan-2-yl)-
Property Insights of Ethanol, 2-(1,4-benzodioxan-2-yl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanol, 2-(1,4-benzodioxan-2-yl)-. With a topological polar surface area (TPSA) of 38.7 Ų, Ethanol, 2-(1,4-benzodioxan-2-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanol, 2-(1,4-benzodioxan-2-yl)- has 1 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 Ethanol, 2-(1,4-benzodioxan-2-yl)-?
The CAS number of Ethanol, 2-(1,4-benzodioxan-2-yl)- is 62590-71-0.
What is the molecular formula of Ethanol, 2-(1,4-benzodioxan-2-yl)-?
The molecular formula of Ethanol, 2-(1,4-benzodioxan-2-yl)- is C10H12O3.
What is the molecular weight of Ethanol, 2-(1,4-benzodioxan-2-yl)-?
The molecular weight of Ethanol, 2-(1,4-benzodioxan-2-yl)- is 180.08 g/mol.
Where can I buy Ethanol, 2-(1,4-benzodioxan-2-yl)-?
You can request a quote for Ethanol, 2-(1,4-benzodioxan-2-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanol, 2-(1,4-benzodioxan-2-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanol, 2-(1,4-benzodioxan-2-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.