Chloromethoxybenzenediol
TL;DR: Chloromethoxybenzenediol (CAS 103339-63-5) is a chemical compound with molecular formula C7H7ClO3 and molecular weight 174.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-6-methoxybenzene-1,2-diol
Also Known As: Chloromethoxybenzenediol, 6-Chloro-3-methoxycatechol, 3-chloro-6-methoxybenzene-1,2-diol, 3-chloro-6-methoxy-benzene-1,2-diol
| Molecular Formula | C7H7ClO3 |
|---|---|
| Molecular Weight | 174.01 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.00838 |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 103339-63-5 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)Cl)O)O |
| InChIKey | BUZODUPRQZRQST-UHFFFAOYSA-N |
Product Overview
Chloromethoxybenzenediol (CAS 103339-63-5), with molecular formula C7H7ClO3 and molecular weight 174.01 g/mol. IUPAC: 3-chloro-6-methoxybenzene-1,2-diol.
Chemical Property Profile of Chloromethoxybenzenediol
Property Insights of Chloromethoxybenzenediol
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloromethoxybenzenediol. With a topological polar surface area (TPSA) of 49.7 Ų, Chloromethoxybenzenediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chloromethoxybenzenediol 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 Chloromethoxybenzenediol?
The CAS number of Chloromethoxybenzenediol is 103339-63-5.
What is the molecular formula of Chloromethoxybenzenediol?
The molecular formula of Chloromethoxybenzenediol is C7H7ClO3.
What is the molecular weight of Chloromethoxybenzenediol?
The molecular weight of Chloromethoxybenzenediol is 174.01 g/mol.
Where can I buy Chloromethoxybenzenediol?
You can request a quote for Chloromethoxybenzenediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloromethoxybenzenediol?
Yes, KEHONG BIO provides custom synthesis services for Chloromethoxybenzenediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.