2-Chloro-4,5-dihydroxybenzaldehyde
TL;DR: 2-Chloro-4,5-dihydroxybenzaldehyde (CAS 37686-56-9) is a chemical compound with molecular formula C7H5ClO3 and molecular weight 171.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-4,5-dihydroxybenzaldehyde
Also Known As: 2-Chloro-4,5-dihydroxybenzaldehyde, 6-chloroprotocatechualdehyde, 6-chloro-3,4-dihydroxybenzaldehyde, Benzaldehyde, 2-chloro-4,5-dihydroxy-, Benzaldehyde,6-chloro-3,4-dihydroxy
| Molecular Formula | C7H5ClO3 |
|---|---|
| Molecular Weight | 171.99 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 171.99272 |
| Heavy Atoms | 11 |
| Complexity | 151.0 |
Chemical Identifiers
| CAS Number | 37686-56-9 |
|---|---|
| SMILES | C1=C(C(=CC(=C1O)O)Cl)C=O |
| InChIKey | VVCAFCGTTRGXOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-4,5-dihydroxybenzaldehyde (CAS 37686-56-9), with molecular formula C7H5ClO3 and molecular weight 171.99 g/mol. IUPAC: 2-chloro-4,5-dihydroxybenzaldehyde.
Chemical Property Profile of 2-Chloro-4,5-dihydroxybenzaldehyde
Property Insights of 2-Chloro-4,5-dihydroxybenzaldehyde
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-4,5-dihydroxybenzaldehyde. With a topological polar surface area (TPSA) of 57.5 Ų, 2-Chloro-4,5-dihydroxybenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-4,5-dihydroxybenzaldehyde 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 2-Chloro-4,5-dihydroxybenzaldehyde?
The CAS number of 2-Chloro-4,5-dihydroxybenzaldehyde is 37686-56-9.
What is the molecular formula of 2-Chloro-4,5-dihydroxybenzaldehyde?
The molecular formula of 2-Chloro-4,5-dihydroxybenzaldehyde is C7H5ClO3.
What is the molecular weight of 2-Chloro-4,5-dihydroxybenzaldehyde?
The molecular weight of 2-Chloro-4,5-dihydroxybenzaldehyde is 171.99 g/mol.
Where can I buy 2-Chloro-4,5-dihydroxybenzaldehyde?
You can request a quote for 2-Chloro-4,5-dihydroxybenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-4,5-dihydroxybenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-4,5-dihydroxybenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.