1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-
TL;DR: 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- (CAS 4361-62-0) is a chemical compound with molecular formula C9H12O3S and molecular weight 200.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)methanol
Also Known As: 2-Methyl-2-(2-thienyl)-1,3-dioxolane-4-methanol, (2-methyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)methanol, 1,3-DIOXOLANE-4-METHANOL, 2-METHYL-2-(2-THIENYL)-, 1,3-Dioxolane-4-methanol,2-methyl-2-(2-thienyl)-, 1,3-DIOXOLANE-4-METHANOL,2-METHYL-2-PROPYL
| Molecular Formula | C9H12O3S |
|---|---|
| Molecular Weight | 200.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 66.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 200.05072 |
| Heavy Atoms | 13 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 4361-62-0 |
|---|---|
| SMILES | CC1(OCC(O1)CO)C2=CC=CS2 |
| InChIKey | HOANEJPRHBZMAR-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- (CAS 4361-62-0), with molecular formula C9H12O3S and molecular weight 200.05 g/mol. IUPAC: (2-methyl-2-thiophen-2-yl-1,3-dioxolan-4-yl)methanol.
Chemical Property Profile of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-
Property Insights of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-. The TPSA of 66.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-. Following Lipinski's Rule of Five, 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- has 1 hydrogen bond donor(s) and 4 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-methyl-2-(2-thienyl)-?
The CAS number of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- is 4361-62-0.
What is the molecular formula of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-?
The molecular formula of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- is C9H12O3S.
What is the molecular weight of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-?
The molecular weight of 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- is 200.05 g/mol.
Where can I buy 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)-?
You can request a quote for 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- 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-methyl-2-(2-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane-4-methanol, 2-methyl-2-(2-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.