4-Methoxybenzyl alcohol
TL;DR: 4-Methoxybenzyl alcohol (CAS 105-13-5) is a chemical compound with molecular formula C8H10O2 and molecular weight 138.06808 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methoxyphenyl)methanol
Also Known As: 4-METHOXYBENZYL ALCOHOL, Anise alcohol, (4-Methoxyphenyl)methanol, Anisyl alcohol, p-Anisyl alcohol
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H10O2 |
| Molecular Weight | 138.06808 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 138.06808 Da |
| Heavy Atoms | 10 |
| Complexity | 85.0 |
| Melting Point | 24 - 25 °C |
| Boiling Point | 259.00 to 260.00 °C. @ 760.00 mm Hg |
| Density | 1.107-1.115 |
| Vapor Pressure | 0.0038 [mmHg] |
| Refractive Index | 1.540-1.547 |
| Solubility | 2 mg/mL at 20 °C |
| SMILES | COC1=CC=C(C=C1)CO |
| InChIKey | MSHFRERJPWKJFX-UHFFFAOYSA-N |
Product Description
Applications: 4-Methoxybenzyl alcohol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-Methoxybenzyl alcohol is a heterocyclic building block identified by CAS number 105-13-5 and the molecular formula C8H10O2 and a molecular weight of 138.07 g/mol. Physically, the compound has a density of 1.107-1.115 g/cm³, a solubility: 2 mg/mL at 20 °C. Synonyms include 4-METHOXYBENZYL ALCOHOL and Anise alcohol.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-Methoxybenzyl alcohol
Property Insights of 4-Methoxybenzyl alcohol
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxybenzyl alcohol. With a topological polar surface area (TPSA) of 29.5 Ų, 4-Methoxybenzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxybenzyl alcohol has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-Methoxybenzyl alcohol?
The CAS number of 4-Methoxybenzyl alcohol is 105-13-5.
What is the molecular formula of 4-Methoxybenzyl alcohol?
The molecular formula of 4-Methoxybenzyl alcohol is C8H10O2.
What is the molecular weight of 4-Methoxybenzyl alcohol?
The molecular weight of 4-Methoxybenzyl alcohol is 138.06808 g/mol.
What are the applications of 4-Methoxybenzyl alcohol?
4-Methoxybenzyl alcohol is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy 4-Methoxybenzyl alcohol?
You can request a quote for 4-Methoxybenzyl alcohol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methoxybenzyl alcohol?
Yes, CoreyChem provides custom synthesis services for 4-Methoxybenzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.