3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene
TL;DR: 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene (CAS 21600-51-1) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.11642 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-(dimethylaminodiazenyl)benzoate
Also Known As: Benzoic acid, ethyl ester, ethyl 4-(dimethylaminodiazenyl)benzoate, 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene, AT 2052, ETHYLBENZOATE433DIMETHYLTRIAZENYL
Technical Specifications
| Molecular Formula | C11H15N3O2 |
| Molecular Weight | 221.11642 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 54.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 221.11642 Da |
| Heavy Atoms | 16 |
| Complexity | 246.0 |
| Solubility | 5.5 [ug/mL] (The mean of the results at pH 7.4) |
| SMILES | CCOC(=O)C1=CC=C(C=C1)N=NN(C)C |
| InChIKey | PDOLRHLZGYQIGP-UHFFFAOYSA-N |
Chemical Property Profile of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene
Property Insights of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene
The XLogP value of 3.7 indicates that 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.3 Ų, 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene?
The CAS number of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene is 21600-51-1.
What is the molecular formula of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene?
The molecular formula of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene is C11H15N3O2.
What is the molecular weight of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene?
The molecular weight of 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene is 221.11642 g/mol.
Where can I buy 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene?
You can request a quote for 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene?
Yes, CoreyChem provides custom synthesis services for 3,3-Dimethyl-1-(4-carbethoxyphenyl)triazene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.