3-(2-Methoxyphenyl)-3-pentanol
TL;DR: 3-(2-Methoxyphenyl)-3-pentanol (CAS 53847-40-8) is a chemical compound with molecular formula C12H18O2 and molecular weight 194.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxyphenyl)pentan-3-ol
Also Known As: 3-(2-Methoxyphenyl)-3-pentanol, 3-(2-methoxyphenyl)pentan-3-ol, 3-(2-Methoxyphenyl)-3-pentanol #, A-Oxy-, A-(2-methoxy-phenyl)-pentan
| Molecular Formula | C12H18O2 |
|---|---|
| Molecular Weight | 194.13 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 194.13068 |
| Heavy Atoms | 14 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 53847-40-8 |
|---|---|
| SMILES | CCC(CC)(C1=CC=CC=C1OC)O |
| InChIKey | NWOYPGORKVCGPR-UHFFFAOYSA-N |
Product Overview
3-(2-Methoxyphenyl)-3-pentanol (CAS 53847-40-8), with molecular formula C12H18O2 and molecular weight 194.13 g/mol. IUPAC: 3-(2-methoxyphenyl)pentan-3-ol.
Chemical Property Profile of 3-(2-Methoxyphenyl)-3-pentanol
Property Insights of 3-(2-Methoxyphenyl)-3-pentanol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Methoxyphenyl)-3-pentanol. With a topological polar surface area (TPSA) of 29.5 Ų, 3-(2-Methoxyphenyl)-3-pentanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methoxyphenyl)-3-pentanol 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
Frequently Asked Questions
What is the CAS number of 3-(2-Methoxyphenyl)-3-pentanol?
The CAS number of 3-(2-Methoxyphenyl)-3-pentanol is 53847-40-8.
What is the molecular formula of 3-(2-Methoxyphenyl)-3-pentanol?
The molecular formula of 3-(2-Methoxyphenyl)-3-pentanol is C12H18O2.
What is the molecular weight of 3-(2-Methoxyphenyl)-3-pentanol?
The molecular weight of 3-(2-Methoxyphenyl)-3-pentanol is 194.13 g/mol.
Where can I buy 3-(2-Methoxyphenyl)-3-pentanol?
You can request a quote for 3-(2-Methoxyphenyl)-3-pentanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Methoxyphenyl)-3-pentanol?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methoxyphenyl)-3-pentanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.