2-氯-4-羟基-5-甲氧基苯甲醛
TL;DR: 2-氯-4-羟基-5-甲氧基苯甲醛 (CAS 18268-76-3) is a chemical compound with molecular formula C8H7ClO3 and molecular weight 186.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-4-羟基-5-甲氧基苯甲醛
2-chloro-4-hydroxy-5-methoxybenzaldehyde
Also Known As: 6-Chlorovanillin, 2-CHLORO-4-HYDROXY-5-METHOXYBENZALDEHYDE, null, 6-chlorovanilin, 2-Chloro-4-hydroxy-5-methoxy-benzaldehyde
| Molecular Formula | C8H7ClO3 |
|---|---|
| Molecular Weight | 186.01 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.00838 |
| Heavy Atoms | 12 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 18268-76-3 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C=O)Cl)O |
| InChIKey | ZOKLABLCKDZYOP-UHFFFAOYSA-N |
Product Overview
2-氯-4-羟基-5-甲氧基苯甲醛 (CAS 18268-76-3), with molecular formula C8H7ClO3 and molecular weight 186.01 g/mol. IUPAC: 2-chloro-4-hydroxy-5-methoxybenzaldehyde.
Chemical Property Profile of 2-氯-4-羟基-5-甲氧基苯甲醛
Property Insights of 2-氯-4-羟基-5-甲氧基苯甲醛
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-4-羟基-5-甲氧基苯甲醛. With a topological polar surface area (TPSA) of 46.5 Ų, 2-氯-4-羟基-5-甲氧基苯甲醛 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氯-4-羟基-5-甲氧基苯甲醛 has 1 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-氯-4-羟基-5-甲氧基苯甲醛?
The CAS number of 2-氯-4-羟基-5-甲氧基苯甲醛 is 18268-76-3.
What is the molecular formula of 2-氯-4-羟基-5-甲氧基苯甲醛?
The molecular formula of 2-氯-4-羟基-5-甲氧基苯甲醛 is C8H7ClO3.
What is the molecular weight of 2-氯-4-羟基-5-甲氧基苯甲醛?
The molecular weight of 2-氯-4-羟基-5-甲氧基苯甲醛 is 186.01 g/mol.
Where can I buy 2-氯-4-羟基-5-甲氧基苯甲醛?
You can request a quote for 2-氯-4-羟基-5-甲氧基苯甲醛 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-4-羟基-5-甲氧基苯甲醛?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-4-羟基-5-甲氧基苯甲醛 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.