2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol
TL;DR: 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol (CAS 4379-18-4) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-methyl-2-(2-methylphenyl)-1,3-dioxolan-4-yl]methanol
Also Known As: 2-Neopentyl-allylalkohol, 2-Methyl-2-(o-tolyl)-1,3-dioxolane-4-methanol, [2-methyl-2-(2-methylphenyl)-1,3-dioxolan-4-yl]methanol, 2-Methyl-2- -1,3-dioxolane-4-methanol, 4-19-00-00784 (Beilstein Handbook Reference)
| Molecular Formula | C12H16O3 |
|---|---|
| Molecular Weight | 208.11 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.10994 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 4379-18-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C2(OCC(O2)CO)C |
| InChIKey | RRJZBWCMQLDFRF-UHFFFAOYSA-N |
Product Overview
2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol (CAS 4379-18-4), with molecular formula C12H16O3 and molecular weight 208.11 g/mol. IUPAC: [2-methyl-2-(2-methylphenyl)-1,3-dioxolan-4-yl]methanol.
Chemical Property Profile of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol
Property Insights of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol. With a topological polar surface area (TPSA) of 38.7 Ų, 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-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-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol?
The CAS number of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol is 4379-18-4.
What is the molecular formula of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol?
The molecular formula of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol is C12H16O3.
What is the molecular weight of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol?
The molecular weight of 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol is 208.11 g/mol.
Where can I buy 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol?
You can request a quote for 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-2-(2-methylphenyl)-1,3-dioxolane-4-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.