Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester
TL;DR: Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester (CAS 106865-10-5) is a chemical compound with molecular formula C12H14Cl2N2O2Si and molecular weight 316.02017 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[1-cyanoethyl(dimethyl)silyl] 3-amino-2,5-dichlorobenzoate
Also Known As: Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester, (1-Cyanoethyl)(dimethyl)silyl 3-amino-2,5-dichlorobenzoate, (1-Cyanoethyl)di(methyl)silyl 3-amino-2,5-dichlorobenzoate, [1-cyanoethyl(dimethyl)silyl] 3-amino-2,5-dichlorobenzoate
Technical Specifications
| Molecular Formula | C12H14Cl2N2O2Si |
| Molecular Weight | 316.02017 g/mol |
| XLogP | 3.85118 |
| Topological Polar Surface Area (TPSA) | 76.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.02017 Da |
| Heavy Atoms | 19 |
| Complexity | 396.0 |
| SMILES | CC(C#N)[Si](C)(C)OC(=O)C1=C(C(=CC(=C1)Cl)N)Cl |
| InChIKey | YITSYSPCIFUAGC-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester
Property Insights of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester
The XLogP value of 3.85118 indicates that Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester. Following Lipinski's Rule of Five, Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester?
The CAS number of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester is 106865-10-5.
What is the molecular formula of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester?
The molecular formula of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester is C12H14Cl2N2O2Si.
What is the molecular weight of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester?
The molecular weight of Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester is 316.02017 g/mol.
Where can I buy Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester?
You can request a quote for Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester?
Yes, CoreyChem provides custom synthesis services for Benzoic Acid, 3-amino-2,5-dichloro-, (1-cyanoethyl)dimethylsilyl Ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.