Benzoimidazol-1-yl-acetic acid
TL;DR: Benzoimidazol-1-yl-acetic acid (CAS 40561-09-9) is a chemical compound with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzimidazol-1-yl)acetic acid
Also Known As: Benzoimidazol-1-yl-acetic acid, 1H-benzimidazol-1-ylacetic acid, null, 1H-Benzimidazole-1-acetic acid, 2-(1H-benzo[d]imidazol-1-yl)acetic acid
| Molecular Formula | C9H8N2O2 |
|---|---|
| Molecular Weight | 176.06 g/mol |
| LogP | 1.1209 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.05858 |
| Heavy Atoms | 13 |
| Complexity | 447.56635 |
Chemical Identifiers
| CAS Number | 40561-09-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=CN2CC(=O)O |
Product Overview
Benzoimidazol-1-yl-acetic acid (CAS 40561-09-9), with molecular formula C9H8N2O2 and molecular weight 176.06 g/mol. IUPAC: 2-(benzimidazol-1-yl)acetic acid.
Chemical Property Profile of Benzoimidazol-1-yl-acetic acid
Property Insights of Benzoimidazol-1-yl-acetic acid
The XLogP value of 1.1209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoimidazol-1-yl-acetic acid. With a topological polar surface area (TPSA) of 55.12 Ų, Benzoimidazol-1-yl-acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoimidazol-1-yl-acetic acid has 1 hydrogen bond donor(s) and 2 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 Benzoimidazol-1-yl-acetic acid?
The CAS number of Benzoimidazol-1-yl-acetic acid is 40561-09-9.
What is the molecular formula of Benzoimidazol-1-yl-acetic acid?
The molecular formula of Benzoimidazol-1-yl-acetic acid is C9H8N2O2.
What is the molecular weight of Benzoimidazol-1-yl-acetic acid?
The molecular weight of Benzoimidazol-1-yl-acetic acid is 176.06 g/mol.
Where can I buy Benzoimidazol-1-yl-acetic acid?
You can request a quote for 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 Benzoimidazol-1-yl-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for Benzoimidazol-1-yl-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.