1,3-Dioxolane-4-butanol, 2-phenyl-
TL;DR: 1,3-Dioxolane-4-butanol, 2-phenyl- (CAS 148254-22-2) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-phenyl-1,3-dioxolan-4-yl)butan-1-ol
Also Known As: 1,3-Dioxolane-4-butanol, 2-phenyl-, 4-(2-phenyl-1,3-dioxolan-4-yl)butan-1-ol, 4-[(2-Phenyl)-1,3-dioxolan4-yl]-1-butanol, 4-(4-hydroxy-1-butyl)-2-phenyl-1,3 dioxolane, 4-[(2-Phenyl)-1,3-dioxolan-4-yl]-1-butanol
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 148254-22-2 |
|---|---|
| SMILES | C1C(OC(O1)C2=CC=CC=C2)CCCCO |
| InChIKey | NOHMXHKKCXAPKY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dioxolane-4-butanol, 2-phenyl- (CAS 148254-22-2), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 4-(2-phenyl-1,3-dioxolan-4-yl)butan-1-ol.
Chemical Property Profile of 1,3-Dioxolane-4-butanol, 2-phenyl-
Property Insights of 1,3-Dioxolane-4-butanol, 2-phenyl-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dioxolane-4-butanol, 2-phenyl-. With a topological polar surface area (TPSA) of 38.7 Ų, 1,3-Dioxolane-4-butanol, 2-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dioxolane-4-butanol, 2-phenyl- 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-butanol, 2-phenyl-?
The CAS number of 1,3-Dioxolane-4-butanol, 2-phenyl- is 148254-22-2.
What is the molecular formula of 1,3-Dioxolane-4-butanol, 2-phenyl-?
The molecular formula of 1,3-Dioxolane-4-butanol, 2-phenyl- is C13H18O3.
What is the molecular weight of 1,3-Dioxolane-4-butanol, 2-phenyl-?
The molecular weight of 1,3-Dioxolane-4-butanol, 2-phenyl- is 222.13 g/mol.
Where can I buy 1,3-Dioxolane-4-butanol, 2-phenyl-?
You can request a quote for 1,3-Dioxolane-4-butanol, 2-phenyl- 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-butanol, 2-phenyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dioxolane-4-butanol, 2-phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.