5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde
TL;DR: 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde (CAS 71730-43-3) is a chemical compound with molecular formula C11H13ClO2 and molecular weight 212.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-tert-butyl-3-chloro-2-hydroxybenzaldehyde
Also Known As: 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde, 5-tert-butyl-3-chloro-2-hydroxybenzaldehyde, 5-(tert-Butyl)-3-chloro-2-hydroxybenzaldehyde, 3-chloro-5-tert-butylsalicylaldehyde, Benzaldehyde, 2-hydroxy, 3-chloro, 5-(t-butyl)
| Molecular Formula | C11H13ClO2 |
|---|---|
| Molecular Weight | 212.06 g/mol |
| LogP | 3.1556 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.06041 |
| Heavy Atoms | 14 |
| Complexity | 364.28568 |
Chemical Identifiers
| CAS Number | 71730-43-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C(=C1)Cl)O)C=O |
Product Overview
5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde (CAS 71730-43-3), with molecular formula C11H13ClO2 and molecular weight 212.06 g/mol. IUPAC: 5-tert-butyl-3-chloro-2-hydroxybenzaldehyde.
Chemical Property Profile of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde
Property Insights of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde
The XLogP value of 3.1556 indicates that 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde 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 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde?
The CAS number of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde is 71730-43-3.
What is the molecular formula of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde?
The molecular formula of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde is C11H13ClO2.
What is the molecular weight of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde?
The molecular weight of 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde is 212.06 g/mol.
Where can I buy 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde?
You can request a quote for 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 5-tert-Butyl-3-chloro-2-hydroxy-benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.