4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde
TL;DR: 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde (CAS 21850-52-2) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[ethyl(2-hydroxyethyl)amino]-2-methylbenzaldehyde
Also Known As: 2-Methyl-N-ethyl-N-(2-hydroxyethyl)-4-aminobenzaldehyde, 4-[ethyl(2-hydroxyethyl)amino]-2-methylbenzaldehyde, 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde, 4-[ethyl(2-hydroxyethyl)amino]-o-tolualdehyde, N-ETHYL-N-HYDROXYETHYL-4-AMINO-2-METHYL BENZALDEHYDE
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 21850-52-2 |
|---|---|
| SMILES | CCN(CCO)C1=CC(=C(C=C1)C=O)C |
| InChIKey | QXOVGKFQCQCWIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde (CAS 21850-52-2), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: 4-[ethyl(2-hydroxyethyl)amino]-2-methylbenzaldehyde.
Chemical Property Profile of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde
Property Insights of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde. With a topological polar surface area (TPSA) of 40.5 Ų, 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde 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 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde?
The CAS number of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde is 21850-52-2.
What is the molecular formula of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde?
The molecular formula of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde is C12H17NO2.
What is the molecular weight of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde?
The molecular weight of 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde is 207.13 g/mol.
Where can I buy 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde?
You can request a quote for 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Ethyl(2-hydroxyethyl)amino)-o-tolualdehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.