(2-Ethyl-1H-benzimidazol-1-yl)acetic acid
TL;DR: (2-Ethyl-1H-benzimidazol-1-yl)acetic acid (CAS 54980-96-0) is a chemical compound with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-ethylbenzimidazol-1-yl)acetic acid
Also Known As: (2-Ethyl-1H-benzimidazol-1-yl)acetic acid, 2-(2-ethyl-1H-1,3-benzodiazol-1-yl)acetic acid, 2-(2-Ethyl-1H-benzo[d]imidazol-1-yl)acetic acid, 2-Ethyl-1H-benzimidazole-1-acetic Acid, 2-(2-ethylbenzimidazol-1-yl)acetic acid
| Molecular Formula | C11H12N2O2 |
|---|---|
| Molecular Weight | 204.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.08987 |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 54980-96-0 |
|---|---|
| SMILES | CCC1=NC2=CC=CC=C2N1CC(=O)O |
| InChIKey | AIOOJAWBQBWGRB-UHFFFAOYSA-N |
Product Overview
(2-Ethyl-1H-benzimidazol-1-yl)acetic acid (CAS 54980-96-0), with molecular formula C11H12N2O2 and molecular weight 204.09 g/mol. IUPAC: 2-(2-ethylbenzimidazol-1-yl)acetic acid.
Chemical Property Profile of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid
Property Insights of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Ethyl-1H-benzimidazol-1-yl)acetic acid. With a topological polar surface area (TPSA) of 55.1 Ų, (2-Ethyl-1H-benzimidazol-1-yl)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Ethyl-1H-benzimidazol-1-yl)acetic acid 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 (2-Ethyl-1H-benzimidazol-1-yl)acetic acid?
The CAS number of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid is 54980-96-0.
What is the molecular formula of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid?
The molecular formula of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid is C11H12N2O2.
What is the molecular weight of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid?
The molecular weight of (2-Ethyl-1H-benzimidazol-1-yl)acetic acid is 204.09 g/mol.
Where can I buy (2-Ethyl-1H-benzimidazol-1-yl)acetic acid?
You can request a quote for (2-Ethyl-1H-benzimidazol-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-Ethyl-1H-benzimidazol-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2-Ethyl-1H-benzimidazol-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.