1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-
TL;DR: 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- (CAS 7761-49-1) is a chemical compound with molecular formula C18H22O4 and molecular weight 302.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(2-hydroxy-3-propan-2-yloxypropoxy)naphthalen-1-yl]ethanone
Also Known As: 1-(4-Acetyl-1-naphthyloxy)-3-isopropoxy-2-propanol, 2-Propanol, 1-(4-acetyl-1-naphthyloxy)-3-isopropoxy-, 4'-((2-Hydroxy-3-isopropoxy)propoxy)-1'-acetonaphthone, 1'-ACETONAPHTHONE, 4'-(2-HYDROXY-3-ISOPROPOXYPROPOXY)-, 3-<4-Acetyl-1-naphthoxy>-1-isopropoxy-2-propanol
| Molecular Formula | C18H22O4 |
|---|---|
| Molecular Weight | 302.15 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 302.1518 |
| Heavy Atoms | 22 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 7761-49-1 |
|---|---|
| SMILES | CC(C)OCC(COC1=CC=C(C2=CC=CC=C21)C(=O)C)O |
| InChIKey | NFGWMGZNGLKAFF-UHFFFAOYSA-N |
Product Overview
1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- (CAS 7761-49-1), with molecular formula C18H22O4 and molecular weight 302.15 g/mol. IUPAC: 1-[4-(2-hydroxy-3-propan-2-yloxypropoxy)naphthalen-1-yl]ethanone.
Chemical Property Profile of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-
Property Insights of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-. With a topological polar surface area (TPSA) of 55.8 Ų, 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- has 1 hydrogen bond donor(s) and 4 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'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-?
The CAS number of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- is 7761-49-1.
What is the molecular formula of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-?
The molecular formula of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- is C18H22O4.
What is the molecular weight of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-?
The molecular weight of 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- is 302.15 g/mol.
Where can I buy 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-?
You can request a quote for 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)-?
Yes, KEHONG BIO provides custom synthesis services for 1'-Acetonaphthone, 4'-(2-hydroxy-3-isopropoxypropoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.