3-Chloro-2-(hydroxyiminomethyl)phenol
TL;DR: 3-Chloro-2-(hydroxyiminomethyl)phenol (CAS 90048-08-1) is a chemical compound with molecular formula C7H6ClNO2 and molecular weight 171.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2-(hydroxyiminomethyl)phenol
Also Known As: (6E)-5-chloro-6-[(hydroxyamino)methylidene]cyclohexa-2,4-die
| Molecular Formula | C7H6ClNO2 |
|---|---|
| Molecular Weight | 171.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 52.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.00871 |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 90048-08-1 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)C=NO)O |
| InChIKey | GATJXNPYNIALRF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloro-2-(hydroxyiminomethyl)phenol (CAS 90048-08-1), with molecular formula C7H6ClNO2 and molecular weight 171.01 g/mol. IUPAC: 3-chloro-2-(hydroxyiminomethyl)phenol.
Chemical Property Profile of 3-Chloro-2-(hydroxyiminomethyl)phenol
Property Insights of 3-Chloro-2-(hydroxyiminomethyl)phenol
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-2-(hydroxyiminomethyl)phenol. With a topological polar surface area (TPSA) of 52.8 Ų, 3-Chloro-2-(hydroxyiminomethyl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-2-(hydroxyiminomethyl)phenol has 2 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 3-Chloro-2-(hydroxyiminomethyl)phenol?
The CAS number of 3-Chloro-2-(hydroxyiminomethyl)phenol is 90048-08-1.
What is the molecular formula of 3-Chloro-2-(hydroxyiminomethyl)phenol?
The molecular formula of 3-Chloro-2-(hydroxyiminomethyl)phenol is C7H6ClNO2.
What is the molecular weight of 3-Chloro-2-(hydroxyiminomethyl)phenol?
The molecular weight of 3-Chloro-2-(hydroxyiminomethyl)phenol is 171.01 g/mol.
Where can I buy 3-Chloro-2-(hydroxyiminomethyl)phenol?
You can request a quote for 3-Chloro-2-(hydroxyiminomethyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2-(hydroxyiminomethyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2-(hydroxyiminomethyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.