Acetic acid, (4-chloro-3-pentadecylphenoxy)-
TL;DR: Acetic acid, (4-chloro-3-pentadecylphenoxy)- (CAS 117554-41-3) is a chemical compound with molecular formula C23H37ClO3 and molecular weight 396.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chloro-3-pentadecylphenoxy)acetic acid
Also Known As: (4-Chloro-3-pentadecylphenoxy)acetic acid, Acetic acid, (4-chloro-3-pentadecylphenoxy)-, 2-(4-chloro-3-pentadecylphenoxy)acetic acid, BRN 5113392, RefChem:316260
| Molecular Formula | C23H37ClO3 |
|---|---|
| Molecular Weight | 396.24 g/mol |
| LogP | 7.4371 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 17 |
| Exact Mass | 396.24313 |
| Heavy Atoms | 27 |
| Complexity | 516.345 |
Chemical Identifiers
| CAS Number | 117554-41-3 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC1=C(C=CC(=C1)OCC(=O)O)Cl |
Product Overview
Acetic acid, (4-chloro-3-pentadecylphenoxy)- (CAS 117554-41-3), with molecular formula C23H37ClO3 and molecular weight 396.24 g/mol. IUPAC: 2-(4-chloro-3-pentadecylphenoxy)acetic acid.
Chemical Property Profile of Acetic acid, (4-chloro-3-pentadecylphenoxy)-
Property Insights of Acetic acid, (4-chloro-3-pentadecylphenoxy)-
The XLogP value of 7.4371 indicates that Acetic acid, (4-chloro-3-pentadecylphenoxy)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Acetic acid, (4-chloro-3-pentadecylphenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (4-chloro-3-pentadecylphenoxy)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acetic acid, (4-chloro-3-pentadecylphenoxy)-?
The CAS number of Acetic acid, (4-chloro-3-pentadecylphenoxy)- is 117554-41-3.
What is the molecular formula of Acetic acid, (4-chloro-3-pentadecylphenoxy)-?
The molecular formula of Acetic acid, (4-chloro-3-pentadecylphenoxy)- is C23H37ClO3.
What is the molecular weight of Acetic acid, (4-chloro-3-pentadecylphenoxy)-?
The molecular weight of Acetic acid, (4-chloro-3-pentadecylphenoxy)- is 396.24 g/mol.
Where can I buy Acetic acid, (4-chloro-3-pentadecylphenoxy)-?
You can request a quote for Acetic acid, (4-chloro-3-pentadecylphenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (4-chloro-3-pentadecylphenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (4-chloro-3-pentadecylphenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.