3-氯-4-羟基苯甲醛
TL;DR: 3-氯-4-羟基苯甲醛 (CAS 2420-16-8) is a chemical compound with molecular formula C7H5ClO2 and molecular weight 156.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-氯-4-羟基苯甲醛
3-chloro-4-hydroxybenzaldehyde
Also Known As: 3-CHLORO-4-HYDROXYBENZALDEHYDE, Benzaldehyde, 3-chloro-4-hydroxy-, 3-chloro-4-hydroxy-benzaldehyde, 4-hydroxy-3-chlorobenzaldehyde, NCIOpen2_001178
| Molecular Formula | C7H5ClO2 |
|---|---|
| Molecular Weight | 156.00 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.9978 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 2420-16-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1C=O)Cl)O |
| InChIKey | VGSOCYWCRMXQAB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-氯-4-羟基苯甲醛 (CAS 2420-16-8), with molecular formula C7H5ClO2 and molecular weight 156.00 g/mol. IUPAC: 3-chloro-4-hydroxybenzaldehyde.
Chemical Property Profile of 3-氯-4-羟基苯甲醛
Property Insights of 3-氯-4-羟基苯甲醛
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-氯-4-羟基苯甲醛. With a topological polar surface area (TPSA) of 37.3 Ų, 3-氯-4-羟基苯甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-氯-4-羟基苯甲醛 has 1 hydrogen bond donor(s) and 2 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-氯-4-羟基苯甲醛?
The CAS number of 3-氯-4-羟基苯甲醛 is 2420-16-8.
What is the molecular formula of 3-氯-4-羟基苯甲醛?
The molecular formula of 3-氯-4-羟基苯甲醛 is C7H5ClO2.
What is the molecular weight of 3-氯-4-羟基苯甲醛?
The molecular weight of 3-氯-4-羟基苯甲醛 is 156.00 g/mol.
Where can I buy 3-氯-4-羟基苯甲醛?
You can request a quote for 3-氯-4-羟基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-氯-4-羟基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 3-氯-4-羟基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.