1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-
TL;DR: 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- (CAS 5694-83-7) is a chemical compound with molecular formula C11H22O3 and molecular weight 202.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-ethyl-2-(3-methylbutyl)-1,3-dioxolan-4-yl]methanol
Also Known As: 2-Ethyl-2-isopentyl-1,3-dioxolane-4-methanol, [2-ethyl-2-(3-methylbutyl)-1,3-dioxolan-4-yl]methanol, 1,3-DIOXOLANE-4-METHANOL, 2-ETHYL-2-ISOPENTYL-, 1,3-DIOXOLANE-4-METHANOL,2-ETHYL-2-ISOPENTYL, 2-Ethyl-2-(3-methylbutyl)-1,3-dioxolane-4-methanol
| Molecular Formula | C11H22O3 |
|---|---|
| Molecular Weight | 202.16 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 202.15689 |
| Heavy Atoms | 14 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 5694-83-7 |
|---|---|
| SMILES | CCC1(OCC(O1)CO)CCC(C)C |
| InChIKey | HNGJBTVYNSPFPZ-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- (CAS 5694-83-7), with molecular formula C11H22O3 and molecular weight 202.16 g/mol. IUPAC: [2-ethyl-2-(3-methylbutyl)-1,3-dioxolan-4-yl]methanol.
Chemical Property Profile of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-
Property Insights of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-. With a topological polar surface area (TPSA) of 38.7 Ų, 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- 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 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-?
The CAS number of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- is 5694-83-7.
What is the molecular formula of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-?
The molecular formula of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- is C11H22O3.
What is the molecular weight of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-?
The molecular weight of 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- is 202.16 g/mol.
Where can I buy 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-?
You can request a quote for 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane-4-methanol, 2-ethyl-2-isopentyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.