(2,5-Dimethyl-1,3-dioxan-5-yl)methanol
TL;DR: (2,5-Dimethyl-1,3-dioxan-5-yl)methanol (CAS 61489-13-2) is a chemical compound with molecular formula C7H14O3 and molecular weight 146.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dimethyl-1,3-dioxan-5-yl)methanol
Also Known As: (2,5-dimethyl-1,3-dioxan-5-yl)methanol, KST-1A6532, 2,5-dimethyl-m-dioxane-5-methanol, 2,5-dimethyl-5-hydroxymethyl-1,3-dioxane, Benzene,1,1'-[2-(phenylethynyl)-1-buten-3-yne-1,4-diyl]bis
| Molecular Formula | C7H14O3 |
|---|---|
| Molecular Weight | 146.09 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 146.0943 |
| Heavy Atoms | 10 |
| Complexity | 105.0 |
Chemical Identifiers
| CAS Number | 61489-13-2 |
|---|---|
| SMILES | CC1OCC(CO1)(C)CO |
| InChIKey | FBLMWUZHKAKZGG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(2,5-Dimethyl-1,3-dioxan-5-yl)methanol (CAS 61489-13-2), with molecular formula C7H14O3 and molecular weight 146.09 g/mol. IUPAC: (2,5-dimethyl-1,3-dioxan-5-yl)methanol.
Chemical Property Profile of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol
Property Insights of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,5-Dimethyl-1,3-dioxan-5-yl)methanol. With a topological polar surface area (TPSA) of 38.7 Ų, (2,5-Dimethyl-1,3-dioxan-5-yl)methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2,5-Dimethyl-1,3-dioxan-5-yl)methanol 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 (2,5-Dimethyl-1,3-dioxan-5-yl)methanol?
The CAS number of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol is 61489-13-2.
What is the molecular formula of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol?
The molecular formula of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol is C7H14O3.
What is the molecular weight of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol?
The molecular weight of (2,5-Dimethyl-1,3-dioxan-5-yl)methanol is 146.09 g/mol.
Where can I buy (2,5-Dimethyl-1,3-dioxan-5-yl)methanol?
You can request a quote for (2,5-Dimethyl-1,3-dioxan-5-yl)methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,5-Dimethyl-1,3-dioxan-5-yl)methanol?
Yes, KEHONG BIO provides custom synthesis services for (2,5-Dimethyl-1,3-dioxan-5-yl)methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.