1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-
TL;DR: 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- (CAS 100125-99-3) is a chemical compound with molecular formula C11H13BrO3 and molecular weight 272.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-bromophenyl)-2-methyl-1,3-dioxolan-4-yl]methanol
Also Known As: 2-(p-Bromophenyl)-2-methyl-1,3-dioxolane-4-methanol, [2-(4-bromophenyl)-2-methyl-1,3-dioxolan-4-yl]methanol, 1,3-DIOXOLANE-4-METHANOL, 2-(p-BROMOPHENYL)-2-METHYL-, RefChem:218986
| Molecular Formula | C11H13BrO3 |
|---|---|
| Molecular Weight | 272.00 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.00482 |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 100125-99-3 |
|---|---|
| SMILES | CC1(OCC(O1)CO)C2=CC=C(C=C2)Br |
| InChIKey | IQLLWQIEWGCXLG-UHFFFAOYSA-N |
Product Overview
1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- (CAS 100125-99-3), with molecular formula C11H13BrO3 and molecular weight 272.00 g/mol. IUPAC: [2-(4-bromophenyl)-2-methyl-1,3-dioxolan-4-yl]methanol.
Chemical Property Profile of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-
Property Insights of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-. With a topological polar surface area (TPSA) of 38.7 Ų, 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- 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-(p-bromophenyl)-2-methyl-?
The CAS number of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- is 100125-99-3.
What is the molecular formula of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-?
The molecular formula of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- is C11H13BrO3.
What is the molecular weight of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-?
The molecular weight of 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- is 272.00 g/mol.
Where can I buy 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl-?
You can request a quote for 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- 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-(p-bromophenyl)-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane-4-methanol, 2-(p-bromophenyl)-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.