Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester
TL;DR: Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester (CAS 59096-06-9) is a chemical compound with molecular formula C12H19NO2Si and molecular weight 237.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(trimethylsilylamino)benzoate
Also Known As: Benzocaine, TMS derivative, Benzocaine,N-trimethylsilyl, Benzocaine, N-trimethylsilyl-, ethyl 4-(trimethylsilylamino)benzoate, 4-((Trimethylsilyl)amino)benzoic acid ethyl ester
| Molecular Formula | C12H19NO2Si |
|---|---|
| Molecular Weight | 237.12 g/mol |
| LogP | 3.11 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 237.1185 |
| Heavy Atoms | 16 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 59096-06-9 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)N[Si](C)(C)C |
| InChIKey | MBUKPTCGZZRZQR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester (CAS 59096-06-9), with molecular formula C12H19NO2Si and molecular weight 237.12 g/mol. IUPAC: ethyl 4-(trimethylsilylamino)benzoate.
Chemical Property Profile of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester
Property Insights of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester
The XLogP value of 3.11 indicates that Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester 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 Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester?
The CAS number of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester is 59096-06-9.
What is the molecular formula of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester?
The molecular formula of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester is C12H19NO2Si.
What is the molecular weight of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester?
The molecular weight of Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester is 237.12 g/mol.
Where can I buy Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester?
You can request a quote for Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-((trimethylsilyl)amino)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.