1H-吲哚-5-甲酸
TL;DR: 1H-吲哚-5-甲酸 (CAS 1670-81-1) is a chemical compound with molecular formula C9H7NO2 and molecular weight 161.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-吲哚-5-甲酸
1H-indole-5-carboxylic acid
Also Known As: Indole-5-carboxylic acid, 1H-indole-5-carboxylic acid, 5-Carboxyindole, null, 5-indolecarboxylic acid
| Molecular Formula | C9H7NO2 |
|---|---|
| Molecular Weight | 161.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 53.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 161.04768 |
| Heavy Atoms | 12 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 1670-81-1 |
|---|---|
| SMILES | C1=CC2=C(C=CN2)C=C1C(=O)O |
| InChIKey | IENZCGNHSIMFJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1H-吲哚-5-甲酸 (CAS 1670-81-1), with molecular formula C9H7NO2 and molecular weight 161.05 g/mol. IUPAC: 1H-indole-5-carboxylic acid.
Chemical Property Profile of 1H-吲哚-5-甲酸
Property Insights of 1H-吲哚-5-甲酸
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-吲哚-5-甲酸. With a topological polar surface area (TPSA) of 53.1 Ų, 1H-吲哚-5-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-吲哚-5-甲酸 has 2 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 1H-吲哚-5-甲酸?
The CAS number of 1H-吲哚-5-甲酸 is 1670-81-1.
What is the molecular formula of 1H-吲哚-5-甲酸?
The molecular formula of 1H-吲哚-5-甲酸 is C9H7NO2.
What is the molecular weight of 1H-吲哚-5-甲酸?
The molecular weight of 1H-吲哚-5-甲酸 is 161.05 g/mol.
Where can I buy 1H-吲哚-5-甲酸?
You can request a quote for 1H-吲哚-5-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-吲哚-5-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1H-吲哚-5-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.