Trichloroacetic acid-aniline(1:1)
TL;DR: Trichloroacetic acid-aniline(1:1) (CAS 27771-75-1) is a chemical compound with molecular formula C8H8Cl3NO2 and molecular weight 254.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
aniline;2,2,2-trichloroacetic acid
Also Known As: trichloroacetic acid- aniline(1:1), Trichloroacetic acid-aniline(1:1), aniline; 2,2,2-trichloroacetic acid, aniline,2,2,2-trichloroacetic acid, Trichloroacetic acid--aniline (1/1)
| Molecular Formula | C8H8Cl3NO2 |
|---|---|
| Molecular Weight | 254.96 g/mol |
| LogP | 2.71 |
| Topological Polar Surface Area | 63.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 254.96207 |
| Heavy Atoms | 14 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 27771-75-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)N.C(=O)(C(Cl)(Cl)Cl)O |
| InChIKey | SVAZOONLLJSQPP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Trichloroacetic acid-aniline(1:1) (CAS 27771-75-1), with molecular formula C8H8Cl3NO2 and molecular weight 254.96 g/mol. IUPAC: aniline;2,2,2-trichloroacetic acid.
Chemical Property Profile of Trichloroacetic acid-aniline(1:1)
Property Insights of Trichloroacetic acid-aniline(1:1)
The XLogP value of 2.71 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichloroacetic acid-aniline(1:1). The TPSA of 63.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichloroacetic acid-aniline(1:1). Following Lipinski's Rule of Five, Trichloroacetic acid-aniline(1:1) has 2 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 Trichloroacetic acid-aniline(1:1)?
The CAS number of Trichloroacetic acid-aniline(1:1) is 27771-75-1.
What is the molecular formula of Trichloroacetic acid-aniline(1:1)?
The molecular formula of Trichloroacetic acid-aniline(1:1) is C8H8Cl3NO2.
What is the molecular weight of Trichloroacetic acid-aniline(1:1)?
The molecular weight of Trichloroacetic acid-aniline(1:1) is 254.96 g/mol.
Where can I buy Trichloroacetic acid-aniline(1:1)?
You can request a quote for Trichloroacetic acid-aniline(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichloroacetic acid-aniline(1:1)?
Yes, KEHONG BIO provides custom synthesis services for Trichloroacetic acid-aniline(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.