4-(Diethylamino)-2-methylbenzaldehyde
TL;DR: 4-(Diethylamino)-2-methylbenzaldehyde (CAS 92-14-8) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(diethylamino)-2-methylbenzaldehyde
Also Known As: 4-(Diethylamino)-2-methylbenzaldehyde, 4-(Diethylamino)-o-tolualdehyde, p-(Diethylamino)-2-tolualdehyde, 4-Diethylamino-2-methyl-benzaldehyde, Benzaldehyde, 4-(diethylamino)-2-methyl-
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 177.0 |
Chemical Identifiers
| CAS Number | 92-14-8 |
|---|---|
| SMILES | CCN(CC)C1=CC(=C(C=C1)C=O)C |
| InChIKey | KCZRCYBAYWJVGD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(Diethylamino)-2-methylbenzaldehyde (CAS 92-14-8), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: 4-(diethylamino)-2-methylbenzaldehyde.
Chemical Property Profile of 4-(Diethylamino)-2-methylbenzaldehyde
Property Insights of 4-(Diethylamino)-2-methylbenzaldehyde
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Diethylamino)-2-methylbenzaldehyde. With a topological polar surface area (TPSA) of 20.3 Ų, 4-(Diethylamino)-2-methylbenzaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Diethylamino)-2-methylbenzaldehyde has 0 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 4-(Diethylamino)-2-methylbenzaldehyde?
The CAS number of 4-(Diethylamino)-2-methylbenzaldehyde is 92-14-8.
What is the molecular formula of 4-(Diethylamino)-2-methylbenzaldehyde?
The molecular formula of 4-(Diethylamino)-2-methylbenzaldehyde is C12H17NO.
What is the molecular weight of 4-(Diethylamino)-2-methylbenzaldehyde?
The molecular weight of 4-(Diethylamino)-2-methylbenzaldehyde is 191.13 g/mol.
Where can I buy 4-(Diethylamino)-2-methylbenzaldehyde?
You can request a quote for 4-(Diethylamino)-2-methylbenzaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Diethylamino)-2-methylbenzaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-(Diethylamino)-2-methylbenzaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.