![3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- structure](/static/products/6248/62489-84-3.webp)
3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-
TL;DR: 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- (CAS 62489-84-3) is a chemical compound with molecular formula C22H33ClO4 and molecular weight 396.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[8-(2-chloro-4-methoxyphenoxy)octyl]heptane-3,5-dione
Also Known As: 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]heptane-3,5-dione, 4-[8-(2-chloro-4-methoxy-phenoxy)octyl]heptane-3,5-dione
| Molecular Formula | C22H33ClO4 |
|---|---|
| Molecular Weight | 396.21 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 396.20673 |
| Heavy Atoms | 27 |
| Complexity | 411.0 |
Chemical Identifiers
| CAS Number | 62489-84-3 |
|---|---|
| SMILES | CCC(=O)C(CCCCCCCCOC1=C(C=C(C=C1)OC)Cl)C(=O)CC |
| InChIKey | PHJCEDSZHDCUML-UHFFFAOYSA-N |
Product Overview
3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- (CAS 62489-84-3), with molecular formula C22H33ClO4 and molecular weight 396.21 g/mol. IUPAC: 4-[8-(2-chloro-4-methoxyphenoxy)octyl]heptane-3,5-dione.
Chemical Property Profile of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-
Property Insights of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-
The XLogP value of 6.3 indicates that 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-?
The CAS number of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- is 62489-84-3.
What is the molecular formula of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-?
The molecular formula of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- is C22H33ClO4.
What is the molecular weight of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-?
The molecular weight of 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- is 396.21 g/mol.
Where can I buy 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-?
You can request a quote for 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]-?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Heptanedione, 4-[8-(2-chloro-4-methoxyphenoxy)octyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.