EINECS 257-409-4
TL;DR: EINECS 257-409-4 (CAS 51773-47-8) is a chemical compound with molecular formula C20H26O3 and molecular weight 314.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-3-hydroxy-2-[2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]cyclopentan-1-one
Also Known As: (2S-(2alpha(E),3beta))-2-(2-(3,4-Dihydro-6-methoxy-1(2H)-naphthylidene)ethyl)-2-ethyl-3-hydroxycyclopentan-1-one, (2R-(2alpha(E),3beta))-2-(2-(3,4-Dihydro-6-methoxy-1(2H)-naphthylidene)ethyl)-2-ethyl-3-hydroxycyclopentan-1-one, [2S-[2alpha(E),3beta]]-2-[2-(3,4-dihydro-6-methoxy-1(2H)-naphthylidene)ethyl]-2-ethyl-3-hydroxycyclopentan-1-one, [2R-[2alpha(E),3beta]]-2-[2-(3,4-dihydro-6-methoxy-1(2H)-naphthylidene)ethyl]-2-ethyl-3-hydroxycyclopentan-1-one, 2-ethyl-3-hydroxy-2-[2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]cyclopentan-1-one
| Molecular Formula | C20H26O3 |
|---|---|
| Molecular Weight | 314.19 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 314.1882 |
| Heavy Atoms | 23 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 51773-47-8 |
|---|---|
| SMILES | CCC1(C(CCC1=O)O)CC=C2CCCC3=C2C=CC(=C3)OC |
| InChIKey | ZXYHLOFRRMDJAQ-UHFFFAOYSA-N |
Product Overview
EINECS 257-409-4 (CAS 51773-47-8), with molecular formula C20H26O3 and molecular weight 314.19 g/mol. IUPAC: 2-ethyl-3-hydroxy-2-[2-(6-methoxy-3,4-dihydro-2H-naphthalen-1-ylidene)ethyl]cyclopentan-1-one.
Chemical Property Profile of EINECS 257-409-4
Property Insights of EINECS 257-409-4
The XLogP value of 3.2 indicates that EINECS 257-409-4 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, EINECS 257-409-4 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, EINECS 257-409-4 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 EINECS 257-409-4?
The CAS number of EINECS 257-409-4 is 51773-47-8.
What is the molecular formula of EINECS 257-409-4?
The molecular formula of EINECS 257-409-4 is C20H26O3.
What is the molecular weight of EINECS 257-409-4?
The molecular weight of EINECS 257-409-4 is 314.19 g/mol.
Where can I buy EINECS 257-409-4?
You can request a quote for EINECS 257-409-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 257-409-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 257-409-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.