RefChem:88481
TL;DR: RefChem:88481 (CAS 55620-96-7) is a chemical compound with molecular formula C18H24O3 and molecular weight 288.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(6-methoxy-3,4-dihydronaphthalen-2-yl)-2,2-dimethylpentanoic acid
Also Known As: E696, E 696, E-696, Pentanoic acid, 2,2-dimethyl-3-(6-methoxy-3,4-dihydro-2-naphthyl)-, 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)-2,2-dimethylpentanoic acid
| Molecular Formula | C18H24O3 |
|---|---|
| Molecular Weight | 288.17 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 288.17255 |
| Heavy Atoms | 21 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 55620-96-7 |
|---|---|
| SMILES | CCC(C1=CC2=C(CC1)C=C(C=C2)OC)C(C)(C)C(=O)O |
| InChIKey | ZQVMDNVYGANWSS-UHFFFAOYSA-N |
Product Overview
RefChem:88481 (CAS 55620-96-7), with molecular formula C18H24O3 and molecular weight 288.17 g/mol. IUPAC: 3-(6-methoxy-3,4-dihydronaphthalen-2-yl)-2,2-dimethylpentanoic acid.
Chemical Property Profile of RefChem:88481
Property Insights of RefChem:88481
The XLogP value of 4.1 indicates that RefChem:88481 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, RefChem:88481 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:88481 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 RefChem:88481?
The CAS number of RefChem:88481 is 55620-96-7.
What is the molecular formula of RefChem:88481?
The molecular formula of RefChem:88481 is C18H24O3.
What is the molecular weight of RefChem:88481?
The molecular weight of RefChem:88481 is 288.17 g/mol.
Where can I buy RefChem:88481?
You can request a quote for RefChem:88481 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:88481?
Yes, KEHONG BIO provides custom synthesis services for RefChem:88481 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.