(2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid
TL;DR: (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid (CAS 72111-09-2) is a chemical compound with molecular formula C10H7F3N2O2 and molecular weight 244.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(trifluoromethyl)benzimidazol-1-yl]acetic acid
Also Known As: (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid, -ACETICACID, Bionet2_000435, [2-(trifluoromethyl)-1H-benzimidazol-1-yl]acetic acid, 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetic acid
| Molecular Formula | C10H7F3N2O2 |
|---|---|
| Molecular Weight | 244.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 244.04596 |
| Heavy Atoms | 17 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 72111-09-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(N2CC(=O)O)C(F)(F)F |
| InChIKey | GPOYZFXQCCJBTF-UHFFFAOYSA-N |
Product Overview
(2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid (CAS 72111-09-2), with molecular formula C10H7F3N2O2 and molecular weight 244.05 g/mol. IUPAC: 2-[2-(trifluoromethyl)benzimidazol-1-yl]acetic acid.
Chemical Property Profile of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid
Property Insights of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid. With a topological polar surface area (TPSA) of 55.1 Ų, (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid has 1 hydrogen bond donor(s) and 6 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 (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid?
The CAS number of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid is 72111-09-2.
What is the molecular formula of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid?
The molecular formula of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid is C10H7F3N2O2.
What is the molecular weight of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid?
The molecular weight of (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid is 244.05 g/mol.
Where can I buy (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid?
You can request a quote for (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-Trifluoromethyl-benzoimidazol-1-yl)-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.