1-茚乙酸
TL;DR: 1-茚乙酸 (CAS 38425-65-9) is a chemical compound with molecular formula C11H12O2 and molecular weight 176.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-茚乙酸
2-(2,3-dihydro-1H-inden-1-yl)acetic acid
Also Known As: 1-Indanacetic acid, 1-Indanylacetic acid, 2-(2,3-dihydro-1H-inden-1-yl)acetic acid, 2-INDANYLACETIC ACID, indanylacetic acid
| Molecular Formula | C11H12O2 |
|---|---|
| Molecular Weight | 176.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 176.08372 |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 38425-65-9 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C1CC(=O)O |
| InChIKey | RJVZEPWRJJBXLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-茚乙酸 (CAS 38425-65-9), with molecular formula C11H12O2 and molecular weight 176.08 g/mol. IUPAC: 2-(2,3-dihydro-1H-inden-1-yl)acetic acid.
Chemical Property Profile of 1-茚乙酸
Property Insights of 1-茚乙酸
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-茚乙酸. With a topological polar surface area (TPSA) of 37.3 Ų, 1-茚乙酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-茚乙酸 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 1-茚乙酸?
The CAS number of 1-茚乙酸 is 38425-65-9.
What is the molecular formula of 1-茚乙酸?
The molecular formula of 1-茚乙酸 is C11H12O2.
What is the molecular weight of 1-茚乙酸?
The molecular weight of 1-茚乙酸 is 176.08 g/mol.
Where can I buy 1-茚乙酸?
You can request a quote for 1-茚乙酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-茚乙酸?
Yes, KEHONG BIO provides custom synthesis services for 1-茚乙酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.