1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-
TL;DR: 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- (CAS 5694-75-7) 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-tert-butyl-2-propan-2-yl-1,3-dioxolan-4-yl)methanol
Also Known As: 2-t-Butyl-2-isopropyl-1,3-dioxolane-4-methanol, 1,3-DIOXOLANE-4-METHANOL, 2-t-BUTYL-2-ISOPROPYL-, (2-tert-butyl-2-propan-2-yl-1,3-dioxolan-4-yl)methanol, 1,3-Dioxolane-4-methanol, 2-(1,1-dimethylethyl)-2-(1-methylethyl)-, 2-TERT-BUTYL-2-ISOPROPYL-1,3-DIOXOLANE-4-METHANOL
| Molecular Formula | C11H22O3 |
|---|---|
| Molecular Weight | 202.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.15689 |
| Heavy Atoms | 14 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 5694-75-7 |
|---|---|
| SMILES | CC(C)C1(OCC(O1)CO)C(C)(C)C |
| InChIKey | ZQKFYBJMYPQDRL-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- (CAS 5694-75-7), with molecular formula C11H22O3 and molecular weight 202.16 g/mol. IUPAC: (2-tert-butyl-2-propan-2-yl-1,3-dioxolan-4-yl)methanol.
Chemical Property Profile of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-
Property Insights of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-. With a topological polar surface area (TPSA) of 38.7 Ų, 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- 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-t-butyl-2-isopropyl-?
The CAS number of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- is 5694-75-7.
What is the molecular formula of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-?
The molecular formula of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- is C11H22O3.
What is the molecular weight of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-?
The molecular weight of 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- is 202.16 g/mol.
Where can I buy 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl-?
You can request a quote for 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- 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-t-butyl-2-isopropyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane-4-methanol, 2-t-butyl-2-isopropyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.