beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid
TL;DR: beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid (CAS 60533-05-3) is a chemical compound with molecular formula C18H20O3 and molecular weight 284.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpent-3-enoic acid
Also Known As: beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid, 3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpent-3-enoic acid, 3-(6-Methoxy-[2]naphthyl)-2,2-dimethyl-pent-3-ensaeure, EINECS 262-282-3
| Molecular Formula | C18H20O3 |
|---|---|
| Molecular Weight | 284.14 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 284.14124 |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 60533-05-3 |
|---|---|
| SMILES | CC=C(C1=CC2=C(C=C1)C=C(C=C2)OC)C(C)(C)C(=O)O |
| InChIKey | ARMLYYXIJXARED-UHFFFAOYSA-N |
Product Overview
beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid (CAS 60533-05-3), with molecular formula C18H20O3 and molecular weight 284.14 g/mol. IUPAC: 3-(6-methoxynaphthalen-2-yl)-2,2-dimethylpent-3-enoic acid.
Chemical Property Profile of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid
Property Insights of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid
The XLogP value of 4.8 indicates that beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid 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 beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid?
The CAS number of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid is 60533-05-3.
What is the molecular formula of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid?
The molecular formula of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid is C18H20O3.
What is the molecular weight of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid?
The molecular weight of beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid is 284.14 g/mol.
Where can I buy beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid?
You can request a quote for beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for beta-Ethylidene-6-methoxy-alpha,alpha-dimethylnaphthalene-2-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.