Methyl 2-(2,6-dimethylanilino)prop-2-enoate
TL;DR: Methyl 2-(2,6-dimethylanilino)prop-2-enoate (CAS 98166-08-6) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(2,6-dimethylanilino)prop-2-enoate
Also Known As: methyl 2-(2,6-dimethylanilino)prop-2-enoate, 2-Propenoic acid, 2-((2,6-dimethylphenyl)amino)-, methyl ester, Methyl 2-[(2,6-dimethylphenyl)amino]prop-2-enoate, methyl 2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]prop-2-enoate
| Molecular Formula | C12H15NO2 |
|---|---|
| Molecular Weight | 205.11 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.11028 |
| Heavy Atoms | 15 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 98166-08-6 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)NC(=C)C(=O)OC |
| InChIKey | VUZVUMHEQUDIBD-UHFFFAOYSA-N |
Product Overview
Methyl 2-(2,6-dimethylanilino)prop-2-enoate (CAS 98166-08-6), with molecular formula C12H15NO2 and molecular weight 205.11 g/mol. IUPAC: methyl 2-(2,6-dimethylanilino)prop-2-enoate.
Chemical Property Profile of Methyl 2-(2,6-dimethylanilino)prop-2-enoate
Property Insights of Methyl 2-(2,6-dimethylanilino)prop-2-enoate
The XLogP value of 3.2 indicates that Methyl 2-(2,6-dimethylanilino)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl 2-(2,6-dimethylanilino)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(2,6-dimethylanilino)prop-2-enoate 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 Methyl 2-(2,6-dimethylanilino)prop-2-enoate?
The CAS number of Methyl 2-(2,6-dimethylanilino)prop-2-enoate is 98166-08-6.
What is the molecular formula of Methyl 2-(2,6-dimethylanilino)prop-2-enoate?
The molecular formula of Methyl 2-(2,6-dimethylanilino)prop-2-enoate is C12H15NO2.
What is the molecular weight of Methyl 2-(2,6-dimethylanilino)prop-2-enoate?
The molecular weight of Methyl 2-(2,6-dimethylanilino)prop-2-enoate is 205.11 g/mol.
Where can I buy Methyl 2-(2,6-dimethylanilino)prop-2-enoate?
You can request a quote for Methyl 2-(2,6-dimethylanilino)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(2,6-dimethylanilino)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(2,6-dimethylanilino)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.