3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde
TL;DR: 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde (CAS 93904-64-4) is a chemical compound with molecular formula C10H11ClO2 and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-4-hydroxy-5-propan-2-ylbenzaldehyde
Also Known As: EINECS 299-803-9, 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde, 3-chloro-4-hydroxy-5-propan-2-ylbenzaldehyde, 3-chloro-4-hydroxy-5-(propan-2-yl)benzaldehyde, 3-Chloro-4-hydroxy-5-(1-methylethyl)benzaldehyde
| Molecular Formula | C10H11ClO2 |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 2.9815 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.04475 |
| Heavy Atoms | 13 |
| Complexity | 331.94177 |
Chemical Identifiers
| CAS Number | 93904-64-4 |
|---|---|
| SMILES | CC(C)C1=C(C(=CC(=C1)C=O)Cl)O |
Product Overview
3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde (CAS 93904-64-4), with molecular formula C10H11ClO2 and molecular weight 198.04 g/mol. IUPAC: 3-chloro-4-hydroxy-5-propan-2-ylbenzaldehyde.
Chemical Property Profile of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde
Property Insights of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde
The XLogP value of 2.9815 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde. With a topological polar surface area (TPSA) of 37.3 Ų, 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloro-4-hydroxy-5-(isopropyl)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 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The CAS number of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde is 93904-64-4.
What is the molecular formula of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The molecular formula of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde is C10H11ClO2.
What is the molecular weight of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
The molecular weight of 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde is 198.04 g/mol.
Where can I buy 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
You can request a quote for 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-4-hydroxy-5-(isopropyl)benzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.