1-(1-Methylethoxy)-3-phenoxy-2-propanol
TL;DR: 1-(1-Methylethoxy)-3-phenoxy-2-propanol (CAS 5133-56-2) is a chemical compound with molecular formula C12H18O3 and molecular weight 210.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenoxy-3-propan-2-yloxypropan-2-ol
Also Known As: 1-Isopropoxy-3-phenoxy-2-propanol, 1-isopropoxy-3-phenoxypropan-2-ol, 1-Isopropyl-3-phenyl diether glycerol, 2-Propanol, 1-isopropoxy-3-phenoxy-, 1-Phenoxy-3-isopropoxy-2-propanol
| Molecular Formula | C12H18O3 |
|---|---|
| Molecular Weight | 210.13 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 210.1256 |
| Heavy Atoms | 15 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 5133-56-2 |
|---|---|
| SMILES | CC(C)OCC(COC1=CC=CC=C1)O |
| InChIKey | JEXLLBRBNFHWRA-UHFFFAOYSA-N |
Product Overview
1-(1-Methylethoxy)-3-phenoxy-2-propanol (CAS 5133-56-2), with molecular formula C12H18O3 and molecular weight 210.13 g/mol. IUPAC: 1-phenoxy-3-propan-2-yloxypropan-2-ol.
Chemical Property Profile of 1-(1-Methylethoxy)-3-phenoxy-2-propanol
Property Insights of 1-(1-Methylethoxy)-3-phenoxy-2-propanol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Methylethoxy)-3-phenoxy-2-propanol. With a topological polar surface area (TPSA) of 38.7 Ų, 1-(1-Methylethoxy)-3-phenoxy-2-propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Methylethoxy)-3-phenoxy-2-propanol 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-(1-Methylethoxy)-3-phenoxy-2-propanol?
The CAS number of 1-(1-Methylethoxy)-3-phenoxy-2-propanol is 5133-56-2.
What is the molecular formula of 1-(1-Methylethoxy)-3-phenoxy-2-propanol?
The molecular formula of 1-(1-Methylethoxy)-3-phenoxy-2-propanol is C12H18O3.
What is the molecular weight of 1-(1-Methylethoxy)-3-phenoxy-2-propanol?
The molecular weight of 1-(1-Methylethoxy)-3-phenoxy-2-propanol is 210.13 g/mol.
Where can I buy 1-(1-Methylethoxy)-3-phenoxy-2-propanol?
You can request a quote for 1-(1-Methylethoxy)-3-phenoxy-2-propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Methylethoxy)-3-phenoxy-2-propanol?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Methylethoxy)-3-phenoxy-2-propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.