Acetic acid, (2-chloro-5-methylphenoxy)-
TL;DR: Acetic acid, (2-chloro-5-methylphenoxy)- (CAS 1556-00-9) is a chemical compound with molecular formula C9H8ClO3- and molecular weight 199.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloro-5-methylphenoxy)acetate
Also Known As: 2-(2-chloro-5-methylphenoxy)acetate, Acetic acid, (2-chloro-5-methylphenoxy)-, (2-Chloro-5-methylphenoxy)acetate
| Molecular Formula | C9H8ClO3- |
|---|---|
| Molecular Weight | 199.02 g/mol |
| LogP | 0.77712 |
| Topological Polar Surface Area | 49.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 199.01619 |
| Heavy Atoms | 13 |
| Complexity | 322.6359 |
Chemical Identifiers
| CAS Number | 1556-00-9 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)Cl)OCC(=O)[O-] |
Product Overview
Acetic acid, (2-chloro-5-methylphenoxy)- (CAS 1556-00-9), with molecular formula C9H8ClO3- and molecular weight 199.02 g/mol. IUPAC: 2-(2-chloro-5-methylphenoxy)acetate.
Chemical Property Profile of Acetic acid, (2-chloro-5-methylphenoxy)-
Property Insights of Acetic acid, (2-chloro-5-methylphenoxy)-
The XLogP value of 0.77712 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetic acid, (2-chloro-5-methylphenoxy)-. With a topological polar surface area (TPSA) of 49.36 Ų, Acetic acid, (2-chloro-5-methylphenoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid, (2-chloro-5-methylphenoxy)- has 0 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 Acetic acid, (2-chloro-5-methylphenoxy)-?
The CAS number of Acetic acid, (2-chloro-5-methylphenoxy)- is 1556-00-9.
What is the molecular formula of Acetic acid, (2-chloro-5-methylphenoxy)-?
The molecular formula of Acetic acid, (2-chloro-5-methylphenoxy)- is C9H8ClO3-.
What is the molecular weight of Acetic acid, (2-chloro-5-methylphenoxy)-?
The molecular weight of Acetic acid, (2-chloro-5-methylphenoxy)- is 199.02 g/mol.
Where can I buy Acetic acid, (2-chloro-5-methylphenoxy)-?
You can request a quote for Acetic acid, (2-chloro-5-methylphenoxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid, (2-chloro-5-methylphenoxy)-?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid, (2-chloro-5-methylphenoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.